USER MOD reduce.3.24.130724 H: found=0, std=0, add=578, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 581 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 394 LYS NZ :NH3+ -121:sc= -4.49! (180deg=-7.2!) USER MOD Set 1.2: A 396 HIS :FLIP no HD1:sc= -2.47! C(o=-7.7!,f=-6.6!) USER MOD Set 1.3: A 405 THR OG1 : rot -94:sc= 0.358 USER MOD Single : A 355 SER OG : rot 180:sc= 0 USER MOD Single : A 356 HIS : no HD1:sc= -2.42 K(o=-2.4,f=-7.9!) USER MOD Single : A 357 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 362 THR OG1 : rot 180:sc= 0 USER MOD Single : A 363 GLN :FLIP amide:sc= 0 F(o=-1.1!,f=0) USER MOD Single : A 364 LYS NZ :NH3+ 165:sc= -0.0413 (180deg=-0.29) USER MOD Single : A 365 HIS : no HD1:sc= -0.134 X(o=-0.13,f=-0.00014) USER MOD Single : A 366 LYS NZ :NH3+ 150:sc= -2.6! (180deg=-4.1!) USER MOD Single : A 370 SER OG : rot 180:sc= 0 USER MOD Single : A 371 GLN : amide:sc= -0.729 K(o=-0.73,f=-2.7!) USER MOD Single : A 372 GLN :FLIP amide:sc= 0 F(o=-1.2!,f=0) USER MOD Single : A 373 GLN : amide:sc= -1.77 X(o=-1.8,f=-1.4) USER MOD Single : A 377 THR OG1 : rot 180:sc=-0.00247 USER MOD Single : A 380 SER OG : rot -140:sc= 0 USER MOD Single : A 382 ASN :FLIP amide:sc= -0.873 F(o=-3.6!,f=-0.87) USER MOD Single : A 383 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 384 LYS NZ :NH3+ -115:sc= -0.145 (180deg=-2.56!) USER MOD Single : A 386 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 387 ASN : amide:sc= -0.017 X(o=-0.017,f=-0.013) USER MOD Single : A 390 LYS NZ :NH3+ 160:sc= 0 (180deg=-0.219) USER MOD Single : A 391 SER OG : rot 170:sc= 0 USER MOD Single : A 397 ASN : amide:sc= -2.9! C(o=-2.9!,f=-3.4!) USER MOD Single : A 401 ASN :FLIP amide:sc= -0.216 F(o=-2.8!,f=-0.22) USER MOD Single : A 402 LYS NZ :NH3+ -167:sc= -0.0583 (180deg=-0.3) USER MOD Single : A 403 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 408 LYS NZ :NH3+ -165:sc= -0.0393 (180deg=-0.313) USER MOD Single : A 412 LYS NZ :NH3+ 177:sc= -2.66! (180deg=-2.71!) USER MOD Single : A 413 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 418 THR OG1 : rot -52:sc= 1.15 USER MOD Single : A 420 LYS NZ :NH3+ -163:sc= -0.0496 (180deg=-0.338) USER MOD Single : A 423 LYS NZ :NH3+ -167:sc= -0.044 (180deg=-0.274) USER MOD Single : A 424 THR OG1 : rot 180:sc= 0 USER MOD Single : A 426 ASN : amide:sc= 0.0992 K(o=0.099,f=-2.9!) USER MOD Single : A 427 THR OG1 : rot 180:sc= 0 USER MOD Single : A 428 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 429 THR OG1 : rot 180:sc= 0 USER MOD Single : A 430 THR OG1 : rot 180:sc= 0 USER MOD Single : A 432 SER OG : rot 30:sc= 0.0997 USER MOD Single : A 433 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 354 17.640 0.268 -27.213 1.00 0.00 N ATOM 2 CA GLY A 354 18.175 1.658 -27.232 1.00 0.00 C ATOM 3 C GLY A 354 18.270 2.264 -25.846 1.00 0.00 C ATOM 4 O GLY A 354 17.871 3.410 -25.635 1.00 0.00 O ATOM 0 HA2 GLY A 354 19.163 1.657 -27.693 1.00 0.00 H new ATOM 0 HA3 GLY A 354 17.534 2.282 -27.854 1.00 0.00 H new ATOM 10 N SER A 355 18.799 1.492 -24.900 1.00 0.00 N ATOM 11 CA SER A 355 18.947 1.952 -23.522 1.00 0.00 C ATOM 12 C SER A 355 19.742 0.947 -22.695 1.00 0.00 C ATOM 13 O SER A 355 19.517 -0.260 -22.785 1.00 0.00 O ATOM 14 CB SER A 355 17.576 2.180 -22.883 1.00 0.00 C ATOM 15 OG SER A 355 17.705 2.626 -21.544 1.00 0.00 O ATOM 0 H SER A 355 19.133 0.542 -25.063 1.00 0.00 H new ATOM 0 HA SER A 355 19.492 2.896 -23.541 1.00 0.00 H new ATOM 0 HB2 SER A 355 17.019 2.916 -23.463 1.00 0.00 H new ATOM 0 HB3 SER A 355 17.001 1.254 -22.907 1.00 0.00 H new ATOM 0 HG SER A 355 16.815 2.766 -21.159 1.00 0.00 H new ATOM 21 N HIS A 356 20.674 1.453 -21.892 1.00 0.00 N ATOM 22 CA HIS A 356 21.505 0.602 -21.048 1.00 0.00 C ATOM 23 C HIS A 356 20.642 -0.206 -20.080 1.00 0.00 C ATOM 24 O HIS A 356 19.657 0.301 -19.543 1.00 0.00 O ATOM 25 CB HIS A 356 22.513 1.452 -20.269 1.00 0.00 C ATOM 26 CG HIS A 356 23.523 0.645 -19.511 1.00 0.00 C ATOM 27 ND1 HIS A 356 23.183 -0.269 -18.536 1.00 0.00 N ATOM 28 CD2 HIS A 356 24.875 0.621 -19.590 1.00 0.00 C ATOM 29 CE1 HIS A 356 24.281 -0.819 -18.049 1.00 0.00 C ATOM 30 NE2 HIS A 356 25.321 -0.297 -18.672 1.00 0.00 N ATOM 0 H HIS A 356 20.872 2.450 -21.809 1.00 0.00 H new ATOM 0 HA HIS A 356 22.047 -0.092 -21.690 1.00 0.00 H new ATOM 0 HB2 HIS A 356 23.034 2.110 -20.964 1.00 0.00 H new ATOM 0 HB3 HIS A 356 21.973 2.091 -19.570 1.00 0.00 H new ATOM 0 HD2 HIS A 356 25.488 1.214 -20.252 1.00 0.00 H new ATOM 0 HE1 HIS A 356 24.321 -1.569 -17.273 1.00 0.00 H new ATOM 0 HE2 HIS A 356 26.297 -0.537 -18.499 1.00 0.00 H new ATOM 39 N MET A 357 21.016 -1.466 -19.872 1.00 0.00 N ATOM 40 CA MET A 357 20.279 -2.354 -18.976 1.00 0.00 C ATOM 41 C MET A 357 20.585 -2.048 -17.509 1.00 0.00 C ATOM 42 O MET A 357 20.960 -2.938 -16.745 1.00 0.00 O ATOM 43 CB MET A 357 20.610 -3.818 -19.287 1.00 0.00 C ATOM 44 CG MET A 357 20.130 -4.283 -20.655 1.00 0.00 C ATOM 45 SD MET A 357 20.920 -3.403 -22.017 1.00 0.00 S ATOM 46 CE MET A 357 20.113 -4.161 -23.425 1.00 0.00 C ATOM 0 H MET A 357 21.828 -1.897 -20.314 1.00 0.00 H new ATOM 0 HA MET A 357 19.215 -2.184 -19.141 1.00 0.00 H new ATOM 0 HB2 MET A 357 21.689 -3.957 -19.225 1.00 0.00 H new ATOM 0 HB3 MET A 357 20.163 -4.452 -18.521 1.00 0.00 H new ATOM 0 HG2 MET A 357 20.324 -5.351 -20.758 1.00 0.00 H new ATOM 0 HG3 MET A 357 19.050 -4.148 -20.720 1.00 0.00 H new ATOM 0 HE1 MET A 357 20.497 -3.720 -24.345 1.00 0.00 H new ATOM 0 HE2 MET A 357 20.312 -5.233 -23.425 1.00 0.00 H new ATOM 0 HE3 MET A 357 19.038 -3.992 -23.363 1.00 0.00 H new ATOM 56 N LEU A 358 20.421 -0.786 -17.121 1.00 0.00 N ATOM 57 CA LEU A 358 20.679 -0.365 -15.748 1.00 0.00 C ATOM 58 C LEU A 358 19.810 -1.144 -14.764 1.00 0.00 C ATOM 59 O LEU A 358 18.608 -1.308 -14.976 1.00 0.00 O ATOM 60 CB LEU A 358 20.418 1.136 -15.599 1.00 0.00 C ATOM 61 CG LEU A 358 21.262 2.035 -16.506 1.00 0.00 C ATOM 62 CD1 LEU A 358 20.855 3.491 -16.338 1.00 0.00 C ATOM 63 CD2 LEU A 358 22.744 1.861 -16.204 1.00 0.00 C ATOM 0 H LEU A 358 20.110 -0.037 -17.739 1.00 0.00 H new ATOM 0 HA LEU A 358 21.725 -0.572 -15.521 1.00 0.00 H new ATOM 0 HB2 LEU A 358 19.364 1.328 -15.802 1.00 0.00 H new ATOM 0 HB3 LEU A 358 20.599 1.419 -14.562 1.00 0.00 H new ATOM 0 HG LEU A 358 21.085 1.742 -17.541 1.00 0.00 H new ATOM 0 HD11 LEU A 358 21.465 4.117 -16.990 1.00 0.00 H new ATOM 0 HD12 LEU A 358 19.804 3.608 -16.602 1.00 0.00 H new ATOM 0 HD13 LEU A 358 21.004 3.793 -15.301 1.00 0.00 H new ATOM 0 HD21 LEU A 358 23.327 2.508 -16.859 1.00 0.00 H new ATOM 0 HD22 LEU A 358 22.937 2.127 -15.165 1.00 0.00 H new ATOM 0 HD23 LEU A 358 23.030 0.823 -16.372 1.00 0.00 H new ATOM 75 N GLU A 359 20.431 -1.627 -13.691 1.00 0.00 N ATOM 76 CA GLU A 359 19.721 -2.397 -12.670 1.00 0.00 C ATOM 77 C GLU A 359 18.950 -1.482 -11.717 1.00 0.00 C ATOM 78 O GLU A 359 18.945 -1.696 -10.504 1.00 0.00 O ATOM 79 CB GLU A 359 20.703 -3.272 -11.877 1.00 0.00 C ATOM 80 CG GLU A 359 21.716 -2.488 -11.050 1.00 0.00 C ATOM 81 CD GLU A 359 22.670 -1.669 -11.897 1.00 0.00 C ATOM 82 OE1 GLU A 359 23.397 -2.268 -12.717 1.00 0.00 O ATOM 83 OE2 GLU A 359 22.690 -0.430 -11.741 1.00 0.00 O ATOM 0 H GLU A 359 21.426 -1.499 -13.505 1.00 0.00 H new ATOM 0 HA GLU A 359 19.003 -3.039 -13.180 1.00 0.00 H new ATOM 0 HB2 GLU A 359 20.136 -3.924 -11.212 1.00 0.00 H new ATOM 0 HB3 GLU A 359 21.240 -3.916 -12.573 1.00 0.00 H new ATOM 0 HG2 GLU A 359 21.184 -1.824 -10.369 1.00 0.00 H new ATOM 0 HG3 GLU A 359 22.290 -3.182 -10.436 1.00 0.00 H new ATOM 90 N VAL A 360 18.295 -0.465 -12.269 1.00 0.00 N ATOM 91 CA VAL A 360 17.524 0.474 -11.461 1.00 0.00 C ATOM 92 C VAL A 360 16.404 -0.233 -10.698 1.00 0.00 C ATOM 93 O VAL A 360 15.570 -0.917 -11.292 1.00 0.00 O ATOM 94 CB VAL A 360 16.920 1.599 -12.326 1.00 0.00 C ATOM 95 CG1 VAL A 360 18.021 2.437 -12.959 1.00 0.00 C ATOM 96 CG2 VAL A 360 16.005 1.023 -13.397 1.00 0.00 C ATOM 0 H VAL A 360 18.283 -0.270 -13.270 1.00 0.00 H new ATOM 0 HA VAL A 360 18.218 0.913 -10.744 1.00 0.00 H new ATOM 0 HB VAL A 360 16.325 2.244 -11.679 1.00 0.00 H new ATOM 0 HG11 VAL A 360 17.575 3.225 -13.565 1.00 0.00 H new ATOM 0 HG12 VAL A 360 18.634 2.884 -12.176 1.00 0.00 H new ATOM 0 HG13 VAL A 360 18.644 1.803 -13.590 1.00 0.00 H new ATOM 0 HG21 VAL A 360 15.590 1.834 -13.995 1.00 0.00 H new ATOM 0 HG22 VAL A 360 16.575 0.352 -14.040 1.00 0.00 H new ATOM 0 HG23 VAL A 360 15.194 0.470 -12.924 1.00 0.00 H new ATOM 106 N LEU A 361 16.397 -0.053 -9.378 1.00 0.00 N ATOM 107 CA LEU A 361 15.386 -0.658 -8.510 1.00 0.00 C ATOM 108 C LEU A 361 15.450 -2.185 -8.568 1.00 0.00 C ATOM 109 O LEU A 361 15.611 -2.777 -9.635 1.00 0.00 O ATOM 110 CB LEU A 361 13.986 -0.155 -8.898 1.00 0.00 C ATOM 111 CG LEU A 361 12.839 -0.542 -7.949 1.00 0.00 C ATOM 112 CD1 LEU A 361 12.465 -2.009 -8.106 1.00 0.00 C ATOM 113 CD2 LEU A 361 13.212 -0.242 -6.503 1.00 0.00 C ATOM 0 H LEU A 361 17.086 0.512 -8.882 1.00 0.00 H new ATOM 0 HA LEU A 361 15.593 -0.358 -7.483 1.00 0.00 H new ATOM 0 HB2 LEU A 361 14.020 0.932 -8.969 1.00 0.00 H new ATOM 0 HB3 LEU A 361 13.750 -0.532 -9.893 1.00 0.00 H new ATOM 0 HG LEU A 361 11.970 0.059 -8.216 1.00 0.00 H new ATOM 0 HD11 LEU A 361 11.652 -2.252 -7.422 1.00 0.00 H new ATOM 0 HD12 LEU A 361 12.145 -2.195 -9.131 1.00 0.00 H new ATOM 0 HD13 LEU A 361 13.330 -2.632 -7.877 1.00 0.00 H new ATOM 0 HD21 LEU A 361 12.387 -0.523 -5.849 1.00 0.00 H new ATOM 0 HD22 LEU A 361 14.101 -0.811 -6.231 1.00 0.00 H new ATOM 0 HD23 LEU A 361 13.415 0.823 -6.393 1.00 0.00 H new ATOM 125 N THR A 362 15.315 -2.816 -7.405 1.00 0.00 N ATOM 126 CA THR A 362 15.353 -4.270 -7.308 1.00 0.00 C ATOM 127 C THR A 362 14.415 -4.768 -6.213 1.00 0.00 C ATOM 128 O THR A 362 14.387 -4.218 -5.111 1.00 0.00 O ATOM 129 CB THR A 362 16.776 -4.784 -7.012 1.00 0.00 C ATOM 130 OG1 THR A 362 17.249 -4.230 -5.779 1.00 0.00 O ATOM 131 CG2 THR A 362 17.733 -4.418 -8.137 1.00 0.00 C ATOM 0 H THR A 362 15.178 -2.340 -6.514 1.00 0.00 H new ATOM 0 HA THR A 362 15.030 -4.657 -8.274 1.00 0.00 H new ATOM 0 HB THR A 362 16.735 -5.870 -6.932 1.00 0.00 H new ATOM 0 HG1 THR A 362 18.153 -4.562 -5.596 1.00 0.00 H new ATOM 0 HG21 THR A 362 18.730 -4.792 -7.903 1.00 0.00 H new ATOM 0 HG22 THR A 362 17.387 -4.865 -9.069 1.00 0.00 H new ATOM 0 HG23 THR A 362 17.769 -3.334 -8.246 1.00 0.00 H new ATOM 139 N GLN A 363 13.648 -5.808 -6.526 1.00 0.00 N ATOM 140 CA GLN A 363 12.706 -6.380 -5.569 1.00 0.00 C ATOM 141 C GLN A 363 13.428 -6.869 -4.316 1.00 0.00 C ATOM 142 O GLN A 363 14.433 -7.576 -4.402 1.00 0.00 O ATOM 143 CB GLN A 363 11.933 -7.533 -6.212 1.00 0.00 C ATOM 144 CG GLN A 363 12.825 -8.623 -6.786 1.00 0.00 C ATOM 145 CD GLN A 363 12.043 -9.765 -7.415 1.00 0.00 C ATOM 146 OE1 GLN A 363 10.716 -9.681 -7.379 1.00 0.00 O flip ATOM 147 NE2 GLN A 363 12.629 -10.719 -7.929 1.00 0.00 N flip ATOM 0 H GLN A 363 13.660 -6.272 -7.434 1.00 0.00 H new ATOM 0 HA GLN A 363 12.004 -5.599 -5.277 1.00 0.00 H new ATOM 0 HB2 GLN A 363 11.270 -7.973 -5.468 1.00 0.00 H new ATOM 0 HB3 GLN A 363 11.302 -7.136 -7.007 1.00 0.00 H new ATOM 0 HG2 GLN A 363 13.485 -8.187 -7.536 1.00 0.00 H new ATOM 0 HG3 GLN A 363 13.460 -9.019 -5.994 1.00 0.00 H new ATOM 0 HE21 GLN A 363 13.649 -10.747 -7.937 1.00 0.00 H new ATOM 0 HE22 GLN A 363 12.095 -11.481 -8.347 1.00 0.00 H new ATOM 156 N LYS A 364 12.911 -6.482 -3.154 1.00 0.00 N ATOM 157 CA LYS A 364 13.508 -6.877 -1.883 1.00 0.00 C ATOM 158 C LYS A 364 12.635 -7.897 -1.155 1.00 0.00 C ATOM 159 O LYS A 364 11.883 -7.547 -0.245 1.00 0.00 O ATOM 160 CB LYS A 364 13.723 -5.648 -0.996 1.00 0.00 C ATOM 161 CG LYS A 364 14.683 -4.627 -1.587 1.00 0.00 C ATOM 162 CD LYS A 364 16.085 -5.198 -1.737 1.00 0.00 C ATOM 163 CE LYS A 364 17.049 -4.169 -2.307 1.00 0.00 C ATOM 164 NZ LYS A 364 17.149 -2.961 -1.442 1.00 0.00 N ATOM 0 H LYS A 364 12.081 -5.896 -3.066 1.00 0.00 H new ATOM 0 HA LYS A 364 14.471 -7.342 -2.095 1.00 0.00 H new ATOM 0 HB2 LYS A 364 12.761 -5.168 -0.817 1.00 0.00 H new ATOM 0 HB3 LYS A 364 14.103 -5.972 -0.027 1.00 0.00 H new ATOM 0 HG2 LYS A 364 14.316 -4.302 -2.561 1.00 0.00 H new ATOM 0 HG3 LYS A 364 14.715 -3.745 -0.948 1.00 0.00 H new ATOM 0 HD2 LYS A 364 16.446 -5.538 -0.766 1.00 0.00 H new ATOM 0 HD3 LYS A 364 16.055 -6.071 -2.389 1.00 0.00 H new ATOM 0 HE2 LYS A 364 18.036 -4.619 -2.418 1.00 0.00 H new ATOM 0 HE3 LYS A 364 16.719 -3.875 -3.303 1.00 0.00 H new ATOM 0 HZ1 LYS A 364 17.984 -2.406 -1.716 1.00 0.00 H new ATOM 0 HZ2 LYS A 364 16.294 -2.380 -1.557 1.00 0.00 H new ATOM 0 HZ3 LYS A 364 17.238 -3.252 -0.448 1.00 0.00 H new ATOM 178 N HIS A 365 12.750 -9.161 -1.558 1.00 0.00 N ATOM 179 CA HIS A 365 11.982 -10.240 -0.943 1.00 0.00 C ATOM 180 C HIS A 365 10.493 -9.906 -0.901 1.00 0.00 C ATOM 181 O HIS A 365 9.827 -10.129 0.111 1.00 0.00 O ATOM 182 CB HIS A 365 12.498 -10.512 0.474 1.00 0.00 C ATOM 183 CG HIS A 365 13.933 -10.944 0.528 1.00 0.00 C ATOM 184 ND1 HIS A 365 14.599 -11.189 1.710 1.00 0.00 N ATOM 185 CD2 HIS A 365 14.830 -11.178 -0.461 1.00 0.00 C ATOM 186 CE1 HIS A 365 15.842 -11.553 1.447 1.00 0.00 C ATOM 187 NE2 HIS A 365 16.007 -11.554 0.137 1.00 0.00 N ATOM 0 H HIS A 365 13.370 -9.463 -2.310 1.00 0.00 H new ATOM 0 HA HIS A 365 12.111 -11.135 -1.552 1.00 0.00 H new ATOM 0 HB2 HIS A 365 12.378 -9.609 1.073 1.00 0.00 H new ATOM 0 HB3 HIS A 365 11.880 -11.283 0.933 1.00 0.00 H new ATOM 0 HD2 HIS A 365 14.652 -11.086 -1.522 1.00 0.00 H new ATOM 0 HE1 HIS A 365 16.595 -11.806 2.179 1.00 0.00 H new ATOM 0 HE2 HIS A 365 16.869 -11.795 -0.352 1.00 0.00 H new ATOM 196 N LYS A 366 9.975 -9.372 -2.004 1.00 0.00 N ATOM 197 CA LYS A 366 8.565 -9.008 -2.088 1.00 0.00 C ATOM 198 C LYS A 366 8.190 -8.592 -3.509 1.00 0.00 C ATOM 199 O LYS A 366 8.975 -7.944 -4.202 1.00 0.00 O ATOM 200 CB LYS A 366 8.247 -7.874 -1.110 1.00 0.00 C ATOM 201 CG LYS A 366 9.071 -6.618 -1.341 1.00 0.00 C ATOM 202 CD LYS A 366 8.760 -5.552 -0.304 1.00 0.00 C ATOM 203 CE LYS A 366 9.584 -4.295 -0.534 1.00 0.00 C ATOM 204 NZ LYS A 366 9.325 -3.261 0.506 1.00 0.00 N ATOM 0 H LYS A 366 10.511 -9.182 -2.851 1.00 0.00 H new ATOM 0 HA LYS A 366 7.976 -9.885 -1.819 1.00 0.00 H new ATOM 0 HB2 LYS A 366 7.189 -7.623 -1.190 1.00 0.00 H new ATOM 0 HB3 LYS A 366 8.415 -8.226 -0.092 1.00 0.00 H new ATOM 0 HG2 LYS A 366 10.132 -6.865 -1.304 1.00 0.00 H new ATOM 0 HG3 LYS A 366 8.869 -6.227 -2.338 1.00 0.00 H new ATOM 0 HD2 LYS A 366 7.699 -5.305 -0.341 1.00 0.00 H new ATOM 0 HD3 LYS A 366 8.961 -5.943 0.693 1.00 0.00 H new ATOM 0 HE2 LYS A 366 10.644 -4.551 -0.535 1.00 0.00 H new ATOM 0 HE3 LYS A 366 9.354 -3.886 -1.518 1.00 0.00 H new ATOM 0 HZ1 LYS A 366 10.181 -2.687 0.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 366 8.543 -2.648 0.199 1.00 0.00 H new ATOM 0 HZ3 LYS A 366 9.070 -3.725 1.401 1.00 0.00 H new ATOM 218 N PRO A 367 6.976 -8.962 -3.963 1.00 0.00 N ATOM 219 CA PRO A 367 6.493 -8.626 -5.304 1.00 0.00 C ATOM 220 C PRO A 367 6.015 -7.181 -5.408 1.00 0.00 C ATOM 221 O PRO A 367 4.934 -6.911 -5.929 1.00 0.00 O ATOM 222 CB PRO A 367 5.335 -9.592 -5.502 1.00 0.00 C ATOM 223 CG PRO A 367 4.803 -9.832 -4.137 1.00 0.00 C ATOM 224 CD PRO A 367 5.976 -9.734 -3.199 1.00 0.00 C ATOM 0 HA PRO A 367 7.276 -8.713 -6.058 1.00 0.00 H new ATOM 0 HB2 PRO A 367 4.572 -9.167 -6.155 1.00 0.00 H new ATOM 0 HB3 PRO A 367 5.669 -10.520 -5.965 1.00 0.00 H new ATOM 0 HG2 PRO A 367 4.040 -9.096 -3.883 1.00 0.00 H new ATOM 0 HG3 PRO A 367 4.334 -10.814 -4.070 1.00 0.00 H new ATOM 0 HD2 PRO A 367 5.705 -9.230 -2.271 1.00 0.00 H new ATOM 0 HD3 PRO A 367 6.354 -10.720 -2.927 1.00 0.00 H new ATOM 232 N ALA A 368 6.830 -6.255 -4.908 1.00 0.00 N ATOM 233 CA ALA A 368 6.495 -4.836 -4.940 1.00 0.00 C ATOM 234 C ALA A 368 7.694 -3.984 -4.535 1.00 0.00 C ATOM 235 O ALA A 368 8.423 -4.326 -3.604 1.00 0.00 O ATOM 236 CB ALA A 368 5.312 -4.551 -4.026 1.00 0.00 C ATOM 0 H ALA A 368 7.729 -6.464 -4.475 1.00 0.00 H new ATOM 0 HA ALA A 368 6.221 -4.574 -5.962 1.00 0.00 H new ATOM 0 HB1 ALA A 368 5.074 -3.488 -4.060 1.00 0.00 H new ATOM 0 HB2 ALA A 368 4.449 -5.127 -4.358 1.00 0.00 H new ATOM 0 HB3 ALA A 368 5.565 -4.833 -3.004 1.00 0.00 H new ATOM 242 N GLU A 369 7.893 -2.876 -5.242 1.00 0.00 N ATOM 243 CA GLU A 369 9.002 -1.976 -4.960 1.00 0.00 C ATOM 244 C GLU A 369 8.932 -1.457 -3.530 1.00 0.00 C ATOM 245 O GLU A 369 7.863 -1.092 -3.039 1.00 0.00 O ATOM 246 CB GLU A 369 9.000 -0.803 -5.941 1.00 0.00 C ATOM 247 CG GLU A 369 9.125 -1.226 -7.395 1.00 0.00 C ATOM 248 CD GLU A 369 9.133 -0.048 -8.350 1.00 0.00 C ATOM 249 OE1 GLU A 369 9.046 1.104 -7.876 1.00 0.00 O ATOM 250 OE2 GLU A 369 9.227 -0.279 -9.574 1.00 0.00 O ATOM 0 H GLU A 369 7.298 -2.581 -6.016 1.00 0.00 H new ATOM 0 HA GLU A 369 9.929 -2.537 -5.079 1.00 0.00 H new ATOM 0 HB2 GLU A 369 8.078 -0.236 -5.814 1.00 0.00 H new ATOM 0 HB3 GLU A 369 9.823 -0.132 -5.694 1.00 0.00 H new ATOM 0 HG2 GLU A 369 10.043 -1.799 -7.524 1.00 0.00 H new ATOM 0 HG3 GLU A 369 8.297 -1.888 -7.649 1.00 0.00 H new ATOM 257 N SER A 370 10.082 -1.433 -2.868 1.00 0.00 N ATOM 258 CA SER A 370 10.168 -0.964 -1.490 1.00 0.00 C ATOM 259 C SER A 370 9.662 0.470 -1.365 1.00 0.00 C ATOM 260 O SER A 370 10.036 1.340 -2.152 1.00 0.00 O ATOM 261 CB SER A 370 11.612 -1.051 -0.992 1.00 0.00 C ATOM 262 OG SER A 370 12.473 -0.252 -1.785 1.00 0.00 O ATOM 0 H SER A 370 10.972 -1.734 -3.265 1.00 0.00 H new ATOM 0 HA SER A 370 9.536 -1.605 -0.876 1.00 0.00 H new ATOM 0 HB2 SER A 370 11.662 -0.725 0.047 1.00 0.00 H new ATOM 0 HB3 SER A 370 11.947 -2.088 -1.017 1.00 0.00 H new ATOM 0 HG SER A 370 13.390 -0.323 -1.446 1.00 0.00 H new ATOM 268 N GLN A 371 8.814 0.705 -0.367 1.00 0.00 N ATOM 269 CA GLN A 371 8.254 2.032 -0.127 1.00 0.00 C ATOM 270 C GLN A 371 7.546 2.562 -1.371 1.00 0.00 C ATOM 271 O GLN A 371 7.668 3.738 -1.714 1.00 0.00 O ATOM 272 CB GLN A 371 9.357 3.003 0.304 1.00 0.00 C ATOM 273 CG GLN A 371 10.107 2.565 1.552 1.00 0.00 C ATOM 274 CD GLN A 371 9.216 2.485 2.778 1.00 0.00 C ATOM 275 OE1 GLN A 371 8.263 1.706 2.821 1.00 0.00 O ATOM 276 NE2 GLN A 371 9.523 3.294 3.785 1.00 0.00 N ATOM 0 H GLN A 371 8.499 -0.009 0.290 1.00 0.00 H new ATOM 0 HA GLN A 371 7.520 1.949 0.674 1.00 0.00 H new ATOM 0 HB2 GLN A 371 10.068 3.117 -0.514 1.00 0.00 H new ATOM 0 HB3 GLN A 371 8.916 3.984 0.482 1.00 0.00 H new ATOM 0 HG2 GLN A 371 10.560 1.590 1.374 1.00 0.00 H new ATOM 0 HG3 GLN A 371 10.921 3.264 1.745 1.00 0.00 H new ATOM 0 HE21 GLN A 371 10.321 3.924 3.708 1.00 0.00 H new ATOM 0 HE22 GLN A 371 8.960 3.285 4.636 1.00 0.00 H new ATOM 285 N GLN A 372 6.803 1.687 -2.040 1.00 0.00 N ATOM 286 CA GLN A 372 6.073 2.063 -3.245 1.00 0.00 C ATOM 287 C GLN A 372 4.977 3.076 -2.921 1.00 0.00 C ATOM 288 O GLN A 372 4.233 2.910 -1.954 1.00 0.00 O ATOM 289 CB GLN A 372 5.463 0.823 -3.902 1.00 0.00 C ATOM 290 CG GLN A 372 4.745 1.113 -5.211 1.00 0.00 C ATOM 291 CD GLN A 372 4.120 -0.123 -5.835 1.00 0.00 C ATOM 292 OE1 GLN A 372 4.266 -1.271 -5.176 1.00 0.00 O flip ATOM 293 NE2 GLN A 372 3.507 -0.049 -6.900 1.00 0.00 N flip ATOM 0 H GLN A 372 6.690 0.711 -1.767 1.00 0.00 H new ATOM 0 HA GLN A 372 6.775 2.525 -3.939 1.00 0.00 H new ATOM 0 HB2 GLN A 372 6.253 0.095 -4.085 1.00 0.00 H new ATOM 0 HB3 GLN A 372 4.760 0.363 -3.207 1.00 0.00 H new ATOM 0 HG2 GLN A 372 3.967 1.856 -5.035 1.00 0.00 H new ATOM 0 HG3 GLN A 372 5.451 1.551 -5.916 1.00 0.00 H new ATOM 0 HE21 GLN A 372 3.417 0.849 -7.375 1.00 0.00 H new ATOM 0 HE22 GLN A 372 3.089 -0.886 -7.307 1.00 0.00 H new ATOM 302 N GLN A 373 4.886 4.126 -3.733 1.00 0.00 N ATOM 303 CA GLN A 373 3.883 5.166 -3.529 1.00 0.00 C ATOM 304 C GLN A 373 2.478 4.586 -3.683 1.00 0.00 C ATOM 305 O GLN A 373 2.151 3.993 -4.711 1.00 0.00 O ATOM 306 CB GLN A 373 4.104 6.307 -4.529 1.00 0.00 C ATOM 307 CG GLN A 373 3.466 7.626 -4.120 1.00 0.00 C ATOM 308 CD GLN A 373 1.955 7.558 -4.047 1.00 0.00 C ATOM 309 OE1 GLN A 373 1.285 7.283 -5.042 1.00 0.00 O ATOM 310 NE2 GLN A 373 1.410 7.811 -2.862 1.00 0.00 N ATOM 0 H GLN A 373 5.494 4.279 -4.537 1.00 0.00 H new ATOM 0 HA GLN A 373 3.983 5.560 -2.518 1.00 0.00 H new ATOM 0 HB2 GLN A 373 5.176 6.459 -4.659 1.00 0.00 H new ATOM 0 HB3 GLN A 373 3.705 6.008 -5.498 1.00 0.00 H new ATOM 0 HG2 GLN A 373 3.858 7.926 -3.148 1.00 0.00 H new ATOM 0 HG3 GLN A 373 3.755 8.399 -4.832 1.00 0.00 H new ATOM 0 HE21 GLN A 373 2.005 8.035 -2.064 1.00 0.00 H new ATOM 0 HE22 GLN A 373 0.397 7.782 -2.750 1.00 0.00 H new ATOM 319 N ALA A 374 1.657 4.749 -2.649 1.00 0.00 N ATOM 320 CA ALA A 374 0.291 4.230 -2.663 1.00 0.00 C ATOM 321 C ALA A 374 -0.609 5.033 -3.598 1.00 0.00 C ATOM 322 O ALA A 374 -0.620 6.262 -3.561 1.00 0.00 O ATOM 323 CB ALA A 374 -0.284 4.225 -1.255 1.00 0.00 C ATOM 0 H ALA A 374 1.913 5.236 -1.790 1.00 0.00 H new ATOM 0 HA ALA A 374 0.329 3.208 -3.039 1.00 0.00 H new ATOM 0 HB1 ALA A 374 -1.302 3.836 -1.279 1.00 0.00 H new ATOM 0 HB2 ALA A 374 0.331 3.594 -0.613 1.00 0.00 H new ATOM 0 HB3 ALA A 374 -0.293 5.242 -0.862 1.00 0.00 H new ATOM 329 N ALA A 375 -1.371 4.327 -4.429 1.00 0.00 N ATOM 330 CA ALA A 375 -2.284 4.970 -5.368 1.00 0.00 C ATOM 331 C ALA A 375 -3.572 5.400 -4.675 1.00 0.00 C ATOM 332 O ALA A 375 -4.664 4.964 -5.037 1.00 0.00 O ATOM 333 CB ALA A 375 -2.584 4.046 -6.539 1.00 0.00 C ATOM 0 H ALA A 375 -1.374 3.308 -4.471 1.00 0.00 H new ATOM 0 HA ALA A 375 -1.797 5.866 -5.752 1.00 0.00 H new ATOM 0 HB1 ALA A 375 -3.266 4.543 -7.229 1.00 0.00 H new ATOM 0 HB2 ALA A 375 -1.657 3.803 -7.058 1.00 0.00 H new ATOM 0 HB3 ALA A 375 -3.044 3.129 -6.170 1.00 0.00 H new ATOM 339 N GLU A 376 -3.422 6.252 -3.672 1.00 0.00 N ATOM 340 CA GLU A 376 -4.551 6.755 -2.899 1.00 0.00 C ATOM 341 C GLU A 376 -5.489 7.603 -3.749 1.00 0.00 C ATOM 342 O GLU A 376 -5.455 8.834 -3.714 1.00 0.00 O ATOM 343 CB GLU A 376 -4.045 7.561 -1.707 1.00 0.00 C ATOM 344 CG GLU A 376 -3.095 8.676 -2.101 1.00 0.00 C ATOM 345 CD GLU A 376 -2.419 9.326 -0.907 1.00 0.00 C ATOM 346 OE1 GLU A 376 -2.683 8.892 0.233 1.00 0.00 O ATOM 347 OE2 GLU A 376 -1.626 10.267 -1.115 1.00 0.00 O ATOM 0 H GLU A 376 -2.517 6.614 -3.370 1.00 0.00 H new ATOM 0 HA GLU A 376 -5.120 5.896 -2.543 1.00 0.00 H new ATOM 0 HB2 GLU A 376 -4.897 7.988 -1.177 1.00 0.00 H new ATOM 0 HB3 GLU A 376 -3.540 6.891 -1.011 1.00 0.00 H new ATOM 0 HG2 GLU A 376 -2.333 8.278 -2.771 1.00 0.00 H new ATOM 0 HG3 GLU A 376 -3.644 9.435 -2.658 1.00 0.00 H new ATOM 354 N THR A 377 -6.336 6.923 -4.497 1.00 0.00 N ATOM 355 CA THR A 377 -7.311 7.577 -5.355 1.00 0.00 C ATOM 356 C THR A 377 -8.574 6.739 -5.456 1.00 0.00 C ATOM 357 O THR A 377 -8.515 5.511 -5.498 1.00 0.00 O ATOM 358 CB THR A 377 -6.768 7.827 -6.773 1.00 0.00 C ATOM 359 OG1 THR A 377 -6.356 6.590 -7.365 1.00 0.00 O ATOM 360 CG2 THR A 377 -5.601 8.803 -6.751 1.00 0.00 C ATOM 0 H THR A 377 -6.370 5.904 -4.529 1.00 0.00 H new ATOM 0 HA THR A 377 -7.532 8.541 -4.898 1.00 0.00 H new ATOM 0 HB THR A 377 -7.568 8.266 -7.369 1.00 0.00 H new ATOM 0 HG1 THR A 377 -6.013 6.758 -8.268 1.00 0.00 H new ATOM 0 HG21 THR A 377 -5.239 8.960 -7.767 1.00 0.00 H new ATOM 0 HG22 THR A 377 -5.930 9.754 -6.332 1.00 0.00 H new ATOM 0 HG23 THR A 377 -4.797 8.395 -6.138 1.00 0.00 H new ATOM 368 N GLU A 378 -9.716 7.413 -5.490 1.00 0.00 N ATOM 369 CA GLU A 378 -11.001 6.734 -5.583 1.00 0.00 C ATOM 370 C GLU A 378 -11.023 5.796 -6.779 1.00 0.00 C ATOM 371 O GLU A 378 -11.555 4.689 -6.707 1.00 0.00 O ATOM 372 CB GLU A 378 -12.129 7.758 -5.703 1.00 0.00 C ATOM 373 CG GLU A 378 -13.518 7.139 -5.724 1.00 0.00 C ATOM 374 CD GLU A 378 -14.619 8.175 -5.859 1.00 0.00 C ATOM 375 OE1 GLU A 378 -14.297 9.381 -5.921 1.00 0.00 O ATOM 376 OE2 GLU A 378 -15.803 7.780 -5.902 1.00 0.00 O ATOM 0 H GLU A 378 -9.778 8.430 -5.455 1.00 0.00 H new ATOM 0 HA GLU A 378 -11.148 6.147 -4.677 1.00 0.00 H new ATOM 0 HB2 GLU A 378 -12.065 8.456 -4.868 1.00 0.00 H new ATOM 0 HB3 GLU A 378 -11.986 8.338 -6.615 1.00 0.00 H new ATOM 0 HG2 GLU A 378 -13.585 6.434 -6.553 1.00 0.00 H new ATOM 0 HG3 GLU A 378 -13.671 6.569 -4.808 1.00 0.00 H new ATOM 383 N GLY A 379 -10.440 6.253 -7.875 1.00 0.00 N ATOM 384 CA GLY A 379 -10.393 5.455 -9.081 1.00 0.00 C ATOM 385 C GLY A 379 -9.613 4.170 -8.909 1.00 0.00 C ATOM 386 O GLY A 379 -9.985 3.138 -9.466 1.00 0.00 O ATOM 0 H GLY A 379 -9.996 7.168 -7.951 1.00 0.00 H new ATOM 0 HA2 GLY A 379 -11.410 5.217 -9.393 1.00 0.00 H new ATOM 0 HA3 GLY A 379 -9.943 6.042 -9.882 1.00 0.00 H new ATOM 390 N SER A 380 -8.528 4.227 -8.147 1.00 0.00 N ATOM 391 CA SER A 380 -7.703 3.048 -7.924 1.00 0.00 C ATOM 392 C SER A 380 -8.421 2.018 -7.060 1.00 0.00 C ATOM 393 O SER A 380 -8.461 0.837 -7.391 1.00 0.00 O ATOM 394 CB SER A 380 -6.386 3.445 -7.272 1.00 0.00 C ATOM 395 OG SER A 380 -5.567 2.312 -7.040 1.00 0.00 O ATOM 0 H SER A 380 -8.201 5.071 -7.676 1.00 0.00 H new ATOM 0 HA SER A 380 -7.504 2.593 -8.894 1.00 0.00 H new ATOM 0 HB2 SER A 380 -5.859 4.153 -7.912 1.00 0.00 H new ATOM 0 HB3 SER A 380 -6.583 3.954 -6.328 1.00 0.00 H new ATOM 0 HG SER A 380 -5.124 2.401 -6.170 1.00 0.00 H new ATOM 401 N CYS A 381 -8.976 2.477 -5.946 1.00 0.00 N ATOM 402 CA CYS A 381 -9.678 1.599 -5.012 1.00 0.00 C ATOM 403 C CYS A 381 -10.828 0.847 -5.677 1.00 0.00 C ATOM 404 O CYS A 381 -10.990 -0.356 -5.469 1.00 0.00 O ATOM 405 CB CYS A 381 -10.202 2.413 -3.833 1.00 0.00 C ATOM 406 SG CYS A 381 -8.896 3.279 -2.911 1.00 0.00 S ATOM 0 H CYS A 381 -8.955 3.457 -5.664 1.00 0.00 H new ATOM 0 HA CYS A 381 -8.963 0.855 -4.662 1.00 0.00 H new ATOM 0 HB2 CYS A 381 -10.923 3.144 -4.199 1.00 0.00 H new ATOM 0 HB3 CYS A 381 -10.737 1.750 -3.153 1.00 0.00 H new ATOM 411 N ASN A 382 -11.627 1.559 -6.465 1.00 0.00 N ATOM 412 CA ASN A 382 -12.766 0.951 -7.149 1.00 0.00 C ATOM 413 C ASN A 382 -12.337 -0.276 -7.945 1.00 0.00 C ATOM 414 O ASN A 382 -13.131 -1.186 -8.182 1.00 0.00 O ATOM 415 CB ASN A 382 -13.428 1.963 -8.087 1.00 0.00 C ATOM 416 CG ASN A 382 -13.929 3.202 -7.366 1.00 0.00 C ATOM 417 OD1 ASN A 382 -13.758 3.243 -6.050 1.00 0.00 O flip ATOM 418 ND2 ASN A 382 -14.468 4.118 -7.990 1.00 0.00 N flip ATOM 0 H ASN A 382 -11.508 2.556 -6.646 1.00 0.00 H new ATOM 0 HA ASN A 382 -13.483 0.640 -6.389 1.00 0.00 H new ATOM 0 HB2 ASN A 382 -12.713 2.260 -8.854 1.00 0.00 H new ATOM 0 HB3 ASN A 382 -14.263 1.484 -8.598 1.00 0.00 H new ATOM 0 HD21 ASN A 382 -14.581 4.049 -9.001 1.00 0.00 H new ATOM 0 HD22 ASN A 382 -14.801 4.945 -7.495 1.00 0.00 H new ATOM 425 N LYS A 383 -11.079 -0.286 -8.365 1.00 0.00 N ATOM 426 CA LYS A 383 -10.538 -1.389 -9.145 1.00 0.00 C ATOM 427 C LYS A 383 -9.993 -2.483 -8.236 1.00 0.00 C ATOM 428 O LYS A 383 -10.084 -3.671 -8.549 1.00 0.00 O ATOM 429 CB LYS A 383 -9.432 -0.867 -10.061 1.00 0.00 C ATOM 430 CG LYS A 383 -9.817 0.404 -10.805 1.00 0.00 C ATOM 431 CD LYS A 383 -10.988 0.176 -11.751 1.00 0.00 C ATOM 432 CE LYS A 383 -10.639 -0.818 -12.849 1.00 0.00 C ATOM 433 NZ LYS A 383 -11.772 -1.025 -13.795 1.00 0.00 N ATOM 0 H LYS A 383 -10.412 0.462 -8.177 1.00 0.00 H new ATOM 0 HA LYS A 383 -11.339 -1.819 -9.747 1.00 0.00 H new ATOM 0 HB2 LYS A 383 -8.538 -0.676 -9.467 1.00 0.00 H new ATOM 0 HB3 LYS A 383 -9.174 -1.640 -10.785 1.00 0.00 H new ATOM 0 HG2 LYS A 383 -10.077 1.181 -10.086 1.00 0.00 H new ATOM 0 HG3 LYS A 383 -8.959 0.768 -11.370 1.00 0.00 H new ATOM 0 HD2 LYS A 383 -11.845 -0.191 -11.187 1.00 0.00 H new ATOM 0 HD3 LYS A 383 -11.284 1.125 -12.199 1.00 0.00 H new ATOM 0 HE2 LYS A 383 -9.768 -0.460 -13.399 1.00 0.00 H new ATOM 0 HE3 LYS A 383 -10.363 -1.772 -12.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 383 -11.493 -1.709 -14.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 383 -12.595 -1.391 -13.276 1.00 0.00 H new ATOM 0 HZ3 LYS A 383 -12.020 -0.120 -14.243 1.00 0.00 H new ATOM 447 N LYS A 384 -9.412 -2.068 -7.117 1.00 0.00 N ATOM 448 CA LYS A 384 -8.831 -2.992 -6.158 1.00 0.00 C ATOM 449 C LYS A 384 -9.892 -3.842 -5.466 1.00 0.00 C ATOM 450 O LYS A 384 -10.865 -3.319 -4.923 1.00 0.00 O ATOM 451 CB LYS A 384 -8.033 -2.201 -5.123 1.00 0.00 C ATOM 452 CG LYS A 384 -6.632 -1.795 -5.575 1.00 0.00 C ATOM 453 CD LYS A 384 -6.588 -1.281 -7.008 1.00 0.00 C ATOM 454 CE LYS A 384 -6.282 -2.394 -8.000 1.00 0.00 C ATOM 455 NZ LYS A 384 -6.250 -1.896 -9.402 1.00 0.00 N ATOM 0 H LYS A 384 -9.332 -1.086 -6.852 1.00 0.00 H new ATOM 0 HA LYS A 384 -8.175 -3.675 -6.697 1.00 0.00 H new ATOM 0 HB2 LYS A 384 -8.591 -1.302 -4.863 1.00 0.00 H new ATOM 0 HB3 LYS A 384 -7.949 -2.798 -4.215 1.00 0.00 H new ATOM 0 HG2 LYS A 384 -6.252 -1.022 -4.907 1.00 0.00 H new ATOM 0 HG3 LYS A 384 -5.965 -2.652 -5.483 1.00 0.00 H new ATOM 0 HD2 LYS A 384 -7.545 -0.823 -7.259 1.00 0.00 H new ATOM 0 HD3 LYS A 384 -5.830 -0.502 -7.091 1.00 0.00 H new ATOM 0 HE2 LYS A 384 -5.321 -2.846 -7.753 1.00 0.00 H new ATOM 0 HE3 LYS A 384 -7.035 -3.177 -7.910 1.00 0.00 H new ATOM 0 HZ1 LYS A 384 -7.025 -2.330 -9.942 1.00 0.00 H new ATOM 0 HZ2 LYS A 384 -6.362 -0.862 -9.406 1.00 0.00 H new ATOM 0 HZ3 LYS A 384 -5.340 -2.147 -9.839 1.00 0.00 H new ATOM 469 N ASP A 385 -9.682 -5.157 -5.474 1.00 0.00 N ATOM 470 CA ASP A 385 -10.606 -6.083 -4.831 1.00 0.00 C ATOM 471 C ASP A 385 -10.373 -6.088 -3.323 1.00 0.00 C ATOM 472 O ASP A 385 -9.684 -5.218 -2.801 1.00 0.00 O ATOM 473 CB ASP A 385 -10.430 -7.493 -5.399 1.00 0.00 C ATOM 474 CG ASP A 385 -10.682 -7.547 -6.893 1.00 0.00 C ATOM 475 OD1 ASP A 385 -11.805 -7.204 -7.319 1.00 0.00 O ATOM 476 OD2 ASP A 385 -9.756 -7.933 -7.637 1.00 0.00 O ATOM 0 H ASP A 385 -8.880 -5.603 -5.919 1.00 0.00 H new ATOM 0 HA ASP A 385 -11.626 -5.755 -5.030 1.00 0.00 H new ATOM 0 HB2 ASP A 385 -9.419 -7.843 -5.190 1.00 0.00 H new ATOM 0 HB3 ASP A 385 -11.114 -8.174 -4.893 1.00 0.00 H new ATOM 481 N GLN A 386 -10.942 -7.069 -2.630 1.00 0.00 N ATOM 482 CA GLN A 386 -10.785 -7.167 -1.180 1.00 0.00 C ATOM 483 C GLN A 386 -9.313 -7.128 -0.780 1.00 0.00 C ATOM 484 O GLN A 386 -8.886 -6.249 -0.030 1.00 0.00 O ATOM 485 CB GLN A 386 -11.428 -8.459 -0.669 1.00 0.00 C ATOM 486 CG GLN A 386 -11.277 -8.665 0.829 1.00 0.00 C ATOM 487 CD GLN A 386 -11.865 -9.983 1.296 1.00 0.00 C ATOM 488 OE1 GLN A 386 -11.447 -11.054 0.854 1.00 0.00 O ATOM 489 NE2 GLN A 386 -12.839 -9.912 2.196 1.00 0.00 N ATOM 0 H GLN A 386 -11.514 -7.805 -3.045 1.00 0.00 H new ATOM 0 HA GLN A 386 -11.284 -6.310 -0.728 1.00 0.00 H new ATOM 0 HB2 GLN A 386 -12.489 -8.451 -0.921 1.00 0.00 H new ATOM 0 HB3 GLN A 386 -10.983 -9.307 -1.190 1.00 0.00 H new ATOM 0 HG2 GLN A 386 -10.220 -8.629 1.093 1.00 0.00 H new ATOM 0 HG3 GLN A 386 -11.766 -7.846 1.356 1.00 0.00 H new ATOM 0 HE21 GLN A 386 -13.155 -9.003 2.535 1.00 0.00 H new ATOM 0 HE22 GLN A 386 -13.271 -10.766 2.548 1.00 0.00 H new ATOM 498 N ASN A 387 -8.543 -8.084 -1.285 1.00 0.00 N ATOM 499 CA ASN A 387 -7.122 -8.166 -0.984 1.00 0.00 C ATOM 500 C ASN A 387 -6.357 -6.988 -1.581 1.00 0.00 C ATOM 501 O ASN A 387 -5.274 -6.637 -1.110 1.00 0.00 O ATOM 502 CB ASN A 387 -6.560 -9.483 -1.516 1.00 0.00 C ATOM 503 CG ASN A 387 -5.067 -9.597 -1.315 1.00 0.00 C ATOM 504 OD1 ASN A 387 -4.573 -9.564 -0.189 1.00 0.00 O ATOM 505 ND2 ASN A 387 -4.339 -9.732 -2.413 1.00 0.00 N ATOM 0 H ASN A 387 -8.883 -8.817 -1.908 1.00 0.00 H new ATOM 0 HA ASN A 387 -6.999 -8.127 0.098 1.00 0.00 H new ATOM 0 HB2 ASN A 387 -7.056 -10.315 -1.015 1.00 0.00 H new ATOM 0 HB3 ASN A 387 -6.788 -9.569 -2.578 1.00 0.00 H new ATOM 0 HD21 ASN A 387 -3.325 -9.814 -2.345 1.00 0.00 H new ATOM 0 HD22 ASN A 387 -4.793 -9.754 -3.326 1.00 0.00 H new ATOM 512 N GLU A 388 -6.917 -6.386 -2.626 1.00 0.00 N ATOM 513 CA GLU A 388 -6.277 -5.257 -3.291 1.00 0.00 C ATOM 514 C GLU A 388 -6.642 -3.935 -2.626 1.00 0.00 C ATOM 515 O GLU A 388 -5.962 -2.929 -2.824 1.00 0.00 O ATOM 516 CB GLU A 388 -6.661 -5.225 -4.770 1.00 0.00 C ATOM 517 CG GLU A 388 -6.224 -6.462 -5.540 1.00 0.00 C ATOM 518 CD GLU A 388 -6.636 -6.420 -6.999 1.00 0.00 C ATOM 519 OE1 GLU A 388 -7.255 -5.417 -7.415 1.00 0.00 O ATOM 520 OE2 GLU A 388 -6.341 -7.391 -7.727 1.00 0.00 O ATOM 0 H GLU A 388 -7.812 -6.661 -3.030 1.00 0.00 H new ATOM 0 HA GLU A 388 -5.199 -5.389 -3.204 1.00 0.00 H new ATOM 0 HB2 GLU A 388 -7.743 -5.119 -4.854 1.00 0.00 H new ATOM 0 HB3 GLU A 388 -6.217 -4.344 -5.233 1.00 0.00 H new ATOM 0 HG2 GLU A 388 -5.140 -6.561 -5.476 1.00 0.00 H new ATOM 0 HG3 GLU A 388 -6.653 -7.347 -5.071 1.00 0.00 H new ATOM 527 N CYS A 389 -7.714 -3.940 -1.838 1.00 0.00 N ATOM 528 CA CYS A 389 -8.151 -2.731 -1.154 1.00 0.00 C ATOM 529 C CYS A 389 -7.002 -2.198 -0.301 1.00 0.00 C ATOM 530 O CYS A 389 -6.727 -2.705 0.786 1.00 0.00 O ATOM 531 CB CYS A 389 -9.388 -3.025 -0.299 1.00 0.00 C ATOM 532 SG CYS A 389 -10.363 -1.551 0.154 1.00 0.00 S ATOM 0 H CYS A 389 -8.291 -4.762 -1.659 1.00 0.00 H new ATOM 0 HA CYS A 389 -8.428 -1.971 -1.885 1.00 0.00 H new ATOM 0 HB2 CYS A 389 -10.032 -3.718 -0.840 1.00 0.00 H new ATOM 0 HB3 CYS A 389 -9.072 -3.530 0.614 1.00 0.00 H new ATOM 537 N LYS A 390 -6.310 -1.198 -0.837 1.00 0.00 N ATOM 538 CA LYS A 390 -5.151 -0.607 -0.177 1.00 0.00 C ATOM 539 C LYS A 390 -5.532 0.206 1.055 1.00 0.00 C ATOM 540 O LYS A 390 -6.695 0.554 1.254 1.00 0.00 O ATOM 541 CB LYS A 390 -4.385 0.259 -1.170 1.00 0.00 C ATOM 542 CG LYS A 390 -3.889 -0.514 -2.384 1.00 0.00 C ATOM 543 CD LYS A 390 -3.115 0.381 -3.337 1.00 0.00 C ATOM 544 CE LYS A 390 -2.628 -0.386 -4.554 1.00 0.00 C ATOM 545 NZ LYS A 390 -1.819 0.473 -5.463 1.00 0.00 N ATOM 0 H LYS A 390 -6.535 -0.776 -1.738 1.00 0.00 H new ATOM 0 HA LYS A 390 -4.516 -1.423 0.169 1.00 0.00 H new ATOM 0 HB2 LYS A 390 -5.029 1.073 -1.504 1.00 0.00 H new ATOM 0 HB3 LYS A 390 -3.533 0.713 -0.664 1.00 0.00 H new ATOM 0 HG2 LYS A 390 -3.252 -1.336 -2.058 1.00 0.00 H new ATOM 0 HG3 LYS A 390 -4.737 -0.956 -2.907 1.00 0.00 H new ATOM 0 HD2 LYS A 390 -3.750 1.207 -3.657 1.00 0.00 H new ATOM 0 HD3 LYS A 390 -2.263 0.817 -2.816 1.00 0.00 H new ATOM 0 HE2 LYS A 390 -2.030 -1.238 -4.231 1.00 0.00 H new ATOM 0 HE3 LYS A 390 -3.484 -0.786 -5.098 1.00 0.00 H new ATOM 0 HZ1 LYS A 390 -1.234 -0.127 -6.079 1.00 0.00 H new ATOM 0 HZ2 LYS A 390 -2.453 1.054 -6.047 1.00 0.00 H new ATOM 0 HZ3 LYS A 390 -1.203 1.093 -4.898 1.00 0.00 H new ATOM 559 N SER A 391 -4.528 0.489 1.888 1.00 0.00 N ATOM 560 CA SER A 391 -4.727 1.249 3.120 1.00 0.00 C ATOM 561 C SER A 391 -5.492 2.550 2.870 1.00 0.00 C ATOM 562 O SER A 391 -6.490 2.813 3.542 1.00 0.00 O ATOM 563 CB SER A 391 -3.380 1.547 3.781 1.00 0.00 C ATOM 564 OG SER A 391 -3.553 2.245 5.002 1.00 0.00 O ATOM 0 H SER A 391 -3.563 0.200 1.728 1.00 0.00 H new ATOM 0 HA SER A 391 -5.330 0.636 3.790 1.00 0.00 H new ATOM 0 HB2 SER A 391 -2.847 0.614 3.965 1.00 0.00 H new ATOM 0 HB3 SER A 391 -2.763 2.139 3.105 1.00 0.00 H new ATOM 0 HG SER A 391 -2.699 2.282 5.482 1.00 0.00 H new ATOM 570 N PRO A 392 -5.057 3.387 1.901 1.00 0.00 N ATOM 571 CA PRO A 392 -5.736 4.643 1.588 1.00 0.00 C ATOM 572 C PRO A 392 -7.226 4.431 1.388 1.00 0.00 C ATOM 573 O PRO A 392 -8.047 5.273 1.751 1.00 0.00 O ATOM 574 CB PRO A 392 -5.085 5.083 0.267 1.00 0.00 C ATOM 575 CG PRO A 392 -4.326 3.900 -0.216 1.00 0.00 C ATOM 576 CD PRO A 392 -3.894 3.196 1.021 1.00 0.00 C ATOM 0 HA PRO A 392 -5.640 5.377 2.388 1.00 0.00 H new ATOM 0 HB2 PRO A 392 -5.838 5.389 -0.459 1.00 0.00 H new ATOM 0 HB3 PRO A 392 -4.425 5.937 0.420 1.00 0.00 H new ATOM 0 HG2 PRO A 392 -4.948 3.258 -0.840 1.00 0.00 H new ATOM 0 HG3 PRO A 392 -3.470 4.199 -0.821 1.00 0.00 H new ATOM 0 HD2 PRO A 392 -3.688 2.141 0.840 1.00 0.00 H new ATOM 0 HD3 PRO A 392 -2.987 3.630 1.442 1.00 0.00 H new ATOM 584 N CYS A 393 -7.557 3.290 0.798 1.00 0.00 N ATOM 585 CA CYS A 393 -8.940 2.935 0.526 1.00 0.00 C ATOM 586 C CYS A 393 -9.711 2.685 1.817 1.00 0.00 C ATOM 587 O CYS A 393 -9.319 3.141 2.890 1.00 0.00 O ATOM 588 CB CYS A 393 -8.983 1.682 -0.349 1.00 0.00 C ATOM 589 SG CYS A 393 -7.988 1.801 -1.868 1.00 0.00 S ATOM 0 H CYS A 393 -6.879 2.590 0.497 1.00 0.00 H new ATOM 0 HA CYS A 393 -9.411 3.769 0.005 1.00 0.00 H new ATOM 0 HB2 CYS A 393 -8.633 0.831 0.236 1.00 0.00 H new ATOM 0 HB3 CYS A 393 -10.018 1.477 -0.621 1.00 0.00 H new ATOM 594 N LYS A 394 -10.804 1.946 1.695 1.00 0.00 N ATOM 595 CA LYS A 394 -11.644 1.608 2.834 1.00 0.00 C ATOM 596 C LYS A 394 -12.609 0.500 2.447 1.00 0.00 C ATOM 597 O LYS A 394 -13.515 0.700 1.640 1.00 0.00 O ATOM 598 CB LYS A 394 -12.408 2.842 3.319 1.00 0.00 C ATOM 599 CG LYS A 394 -13.307 2.574 4.516 1.00 0.00 C ATOM 600 CD LYS A 394 -13.918 3.855 5.073 1.00 0.00 C ATOM 601 CE LYS A 394 -14.875 4.510 4.086 1.00 0.00 C ATOM 602 NZ LYS A 394 -14.166 5.127 2.930 1.00 0.00 N ATOM 0 H LYS A 394 -11.132 1.565 0.807 1.00 0.00 H new ATOM 0 HA LYS A 394 -11.013 1.257 3.650 1.00 0.00 H new ATOM 0 HB2 LYS A 394 -11.693 3.622 3.581 1.00 0.00 H new ATOM 0 HB3 LYS A 394 -13.014 3.228 2.500 1.00 0.00 H new ATOM 0 HG2 LYS A 394 -14.104 1.890 4.224 1.00 0.00 H new ATOM 0 HG3 LYS A 394 -12.731 2.078 5.297 1.00 0.00 H new ATOM 0 HD2 LYS A 394 -14.450 3.630 5.998 1.00 0.00 H new ATOM 0 HD3 LYS A 394 -13.122 4.556 5.325 1.00 0.00 H new ATOM 0 HE2 LYS A 394 -15.581 3.765 3.720 1.00 0.00 H new ATOM 0 HE3 LYS A 394 -15.457 5.274 4.601 1.00 0.00 H new ATOM 0 HZ1 LYS A 394 -14.384 6.143 2.891 1.00 0.00 H new ATOM 0 HZ2 LYS A 394 -13.140 4.997 3.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 394 -14.478 4.672 2.048 1.00 0.00 H new ATOM 616 N TRP A 395 -12.386 -0.678 3.015 1.00 0.00 N ATOM 617 CA TRP A 395 -13.214 -1.836 2.719 1.00 0.00 C ATOM 618 C TRP A 395 -14.627 -1.665 3.264 1.00 0.00 C ATOM 619 O TRP A 395 -14.817 -1.299 4.423 1.00 0.00 O ATOM 620 CB TRP A 395 -12.575 -3.099 3.300 1.00 0.00 C ATOM 621 CG TRP A 395 -13.221 -4.367 2.830 1.00 0.00 C ATOM 622 CD1 TRP A 395 -13.724 -5.368 3.609 1.00 0.00 C ATOM 623 CD2 TRP A 395 -13.420 -4.775 1.471 1.00 0.00 C ATOM 624 NE1 TRP A 395 -14.230 -6.372 2.818 1.00 0.00 N ATOM 625 CE2 TRP A 395 -14.054 -6.031 1.503 1.00 0.00 C ATOM 626 CE3 TRP A 395 -13.126 -4.199 0.230 1.00 0.00 C ATOM 627 CZ2 TRP A 395 -14.398 -6.720 0.343 1.00 0.00 C ATOM 628 CZ3 TRP A 395 -13.470 -4.886 -0.920 1.00 0.00 C ATOM 629 CH2 TRP A 395 -14.100 -6.134 -0.856 1.00 0.00 C ATOM 0 H TRP A 395 -11.637 -0.855 3.684 1.00 0.00 H new ATOM 0 HA TRP A 395 -13.283 -1.932 1.635 1.00 0.00 H new ATOM 0 HB2 TRP A 395 -11.519 -3.118 3.032 1.00 0.00 H new ATOM 0 HB3 TRP A 395 -12.627 -3.056 4.388 1.00 0.00 H new ATOM 0 HD1 TRP A 395 -13.725 -5.371 4.689 1.00 0.00 H new ATOM 0 HE1 TRP A 395 -14.665 -7.231 3.155 1.00 0.00 H new ATOM 0 HE3 TRP A 395 -12.640 -3.236 0.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 395 -14.883 -7.684 0.389 1.00 0.00 H new ATOM 0 HZ3 TRP A 395 -13.249 -4.452 -1.884 1.00 0.00 H new ATOM 0 HH2 TRP A 395 -14.356 -6.645 -1.772 1.00 0.00 H new ATOM 640 N HIS A 396 -15.615 -1.946 2.420 1.00 0.00 N ATOM 641 CA HIS A 396 -17.013 -1.838 2.817 1.00 0.00 C ATOM 642 C HIS A 396 -17.694 -3.198 2.790 1.00 0.00 C ATOM 643 O HIS A 396 -18.013 -3.719 1.717 1.00 0.00 O ATOM 644 CB HIS A 396 -17.762 -0.872 1.894 1.00 0.00 C ATOM 645 CG HIS A 396 -17.519 0.569 2.211 1.00 0.00 C ATOM 646 ND1 HIS A 396 -16.992 1.567 1.463 1.00 0.00 N flip ATOM 647 CD2 HIS A 396 -17.839 1.134 3.428 1.00 0.00 C flip ATOM 648 CE1 HIS A 396 -17.004 2.703 2.235 1.00 0.00 C flip ATOM 649 NE2 HIS A 396 -17.520 2.415 3.415 1.00 0.00 N flip ATOM 0 H HIS A 396 -15.472 -2.250 1.457 1.00 0.00 H new ATOM 0 HA HIS A 396 -17.039 -1.453 3.836 1.00 0.00 H new ATOM 0 HB2 HIS A 396 -17.465 -1.064 0.863 1.00 0.00 H new ATOM 0 HB3 HIS A 396 -18.831 -1.075 1.960 1.00 0.00 H new ATOM 0 HD2 HIS A 396 -18.282 0.610 4.262 1.00 0.00 H new ATOM 0 HE1 HIS A 396 -16.649 3.675 1.926 1.00 0.00 H new ATOM 0 HE2 HIS A 396 -17.650 3.070 4.186 1.00 0.00 H new ATOM 658 N ASN A 397 -17.930 -3.764 3.973 1.00 0.00 N ATOM 659 CA ASN A 397 -18.595 -5.054 4.067 1.00 0.00 C ATOM 660 C ASN A 397 -20.088 -4.867 3.841 1.00 0.00 C ATOM 661 O ASN A 397 -20.858 -4.718 4.790 1.00 0.00 O ATOM 662 CB ASN A 397 -18.342 -5.690 5.437 1.00 0.00 C ATOM 663 CG ASN A 397 -18.945 -7.076 5.556 1.00 0.00 C ATOM 664 OD1 ASN A 397 -20.159 -7.249 5.450 1.00 0.00 O ATOM 665 ND2 ASN A 397 -18.098 -8.073 5.780 1.00 0.00 N ATOM 0 H ASN A 397 -17.672 -3.351 4.869 1.00 0.00 H new ATOM 0 HA ASN A 397 -18.193 -5.720 3.304 1.00 0.00 H new ATOM 0 HB2 ASN A 397 -17.268 -5.749 5.614 1.00 0.00 H new ATOM 0 HB3 ASN A 397 -18.758 -5.049 6.214 1.00 0.00 H new ATOM 0 HD21 ASN A 397 -18.446 -9.027 5.871 1.00 0.00 H new ATOM 0 HD22 ASN A 397 -17.099 -7.885 5.861 1.00 0.00 H new ATOM 672 N ASP A 398 -20.470 -4.869 2.565 1.00 0.00 N ATOM 673 CA ASP A 398 -21.856 -4.687 2.137 1.00 0.00 C ATOM 674 C ASP A 398 -21.872 -4.290 0.664 1.00 0.00 C ATOM 675 O ASP A 398 -21.240 -4.944 -0.160 1.00 0.00 O ATOM 676 CB ASP A 398 -22.569 -3.620 2.984 1.00 0.00 C ATOM 677 CG ASP A 398 -21.882 -2.268 2.926 1.00 0.00 C ATOM 678 OD1 ASP A 398 -20.694 -2.184 3.304 1.00 0.00 O ATOM 679 OD2 ASP A 398 -22.535 -1.290 2.502 1.00 0.00 O ATOM 0 H ASP A 398 -19.819 -4.998 1.791 1.00 0.00 H new ATOM 0 HA ASP A 398 -22.392 -5.626 2.275 1.00 0.00 H new ATOM 0 HB2 ASP A 398 -23.597 -3.515 2.638 1.00 0.00 H new ATOM 0 HB3 ASP A 398 -22.614 -3.955 4.020 1.00 0.00 H new ATOM 684 N ALA A 399 -22.570 -3.206 0.334 1.00 0.00 N ATOM 685 CA ALA A 399 -22.628 -2.727 -1.039 1.00 0.00 C ATOM 686 C ALA A 399 -23.098 -3.824 -1.992 1.00 0.00 C ATOM 687 O ALA A 399 -23.841 -4.723 -1.598 1.00 0.00 O ATOM 688 CB ALA A 399 -21.257 -2.198 -1.455 1.00 0.00 C ATOM 0 H ALA A 399 -23.102 -2.645 1.000 1.00 0.00 H new ATOM 0 HA ALA A 399 -23.356 -1.917 -1.093 1.00 0.00 H new ATOM 0 HB1 ALA A 399 -21.302 -1.840 -2.483 1.00 0.00 H new ATOM 0 HB2 ALA A 399 -20.969 -1.378 -0.797 1.00 0.00 H new ATOM 0 HB3 ALA A 399 -20.521 -2.998 -1.382 1.00 0.00 H new ATOM 694 N GLU A 400 -22.663 -3.745 -3.247 1.00 0.00 N ATOM 695 CA GLU A 400 -23.040 -4.731 -4.255 1.00 0.00 C ATOM 696 C GLU A 400 -22.024 -5.868 -4.316 1.00 0.00 C ATOM 697 O GLU A 400 -21.240 -5.956 -5.262 1.00 0.00 O ATOM 698 CB GLU A 400 -23.172 -4.069 -5.628 1.00 0.00 C ATOM 699 CG GLU A 400 -23.635 -5.020 -6.722 1.00 0.00 C ATOM 700 CD GLU A 400 -23.737 -4.346 -8.076 1.00 0.00 C ATOM 701 OE1 GLU A 400 -22.706 -3.844 -8.569 1.00 0.00 O ATOM 702 OE2 GLU A 400 -24.849 -4.322 -8.644 1.00 0.00 O ATOM 0 H GLU A 400 -22.048 -3.007 -3.590 1.00 0.00 H new ATOM 0 HA GLU A 400 -24.005 -5.149 -3.971 1.00 0.00 H new ATOM 0 HB2 GLU A 400 -23.877 -3.241 -5.556 1.00 0.00 H new ATOM 0 HB3 GLU A 400 -22.209 -3.644 -5.911 1.00 0.00 H new ATOM 0 HG2 GLU A 400 -22.940 -5.857 -6.788 1.00 0.00 H new ATOM 0 HG3 GLU A 400 -24.607 -5.433 -6.452 1.00 0.00 H new ATOM 709 N ASN A 401 -22.032 -6.721 -3.287 1.00 0.00 N ATOM 710 CA ASN A 401 -21.110 -7.849 -3.196 1.00 0.00 C ATOM 711 C ASN A 401 -19.749 -7.359 -2.733 1.00 0.00 C ATOM 712 O ASN A 401 -18.712 -7.721 -3.290 1.00 0.00 O ATOM 713 CB ASN A 401 -20.989 -8.589 -4.536 1.00 0.00 C ATOM 714 CG ASN A 401 -22.324 -9.100 -5.055 1.00 0.00 C ATOM 715 OD1 ASN A 401 -23.397 -8.856 -4.308 1.00 0.00 O flip ATOM 716 ND2 ASN A 401 -22.390 -9.710 -6.121 1.00 0.00 N flip ATOM 0 H ASN A 401 -22.676 -6.647 -2.499 1.00 0.00 H new ATOM 0 HA ASN A 401 -21.506 -8.557 -2.468 1.00 0.00 H new ATOM 0 HB2 ASN A 401 -20.550 -7.920 -5.276 1.00 0.00 H new ATOM 0 HB3 ASN A 401 -20.305 -9.429 -4.420 1.00 0.00 H new ATOM 0 HD21 ASN A 401 -21.544 -9.878 -6.666 1.00 0.00 H new ATOM 0 HD22 ASN A 401 -23.291 -10.048 -6.460 1.00 0.00 H new ATOM 723 N LYS A 402 -19.787 -6.520 -1.704 1.00 0.00 N ATOM 724 CA LYS A 402 -18.581 -5.934 -1.117 1.00 0.00 C ATOM 725 C LYS A 402 -17.941 -4.943 -2.085 1.00 0.00 C ATOM 726 O LYS A 402 -17.808 -5.227 -3.276 1.00 0.00 O ATOM 727 CB LYS A 402 -17.580 -7.027 -0.739 1.00 0.00 C ATOM 728 CG LYS A 402 -18.141 -8.069 0.215 1.00 0.00 C ATOM 729 CD LYS A 402 -18.562 -7.450 1.538 1.00 0.00 C ATOM 730 CE LYS A 402 -19.100 -8.501 2.498 1.00 0.00 C ATOM 731 NZ LYS A 402 -20.280 -9.213 1.934 1.00 0.00 N ATOM 0 H LYS A 402 -20.652 -6.225 -1.251 1.00 0.00 H new ATOM 0 HA LYS A 402 -18.868 -5.399 -0.212 1.00 0.00 H new ATOM 0 HB2 LYS A 402 -17.240 -7.525 -1.647 1.00 0.00 H new ATOM 0 HB3 LYS A 402 -16.705 -6.564 -0.283 1.00 0.00 H new ATOM 0 HG2 LYS A 402 -18.998 -8.561 -0.246 1.00 0.00 H new ATOM 0 HG3 LYS A 402 -17.391 -8.839 0.396 1.00 0.00 H new ATOM 0 HD2 LYS A 402 -17.710 -6.943 1.991 1.00 0.00 H new ATOM 0 HD3 LYS A 402 -19.326 -6.693 1.360 1.00 0.00 H new ATOM 0 HE2 LYS A 402 -18.315 -9.222 2.725 1.00 0.00 H new ATOM 0 HE3 LYS A 402 -19.378 -8.026 3.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 402 -20.750 -9.756 2.686 1.00 0.00 H new ATOM 0 HZ2 LYS A 402 -20.947 -8.520 1.539 1.00 0.00 H new ATOM 0 HZ3 LYS A 402 -19.968 -9.861 1.182 1.00 0.00 H new ATOM 745 N LYS A 403 -17.560 -3.771 -1.576 1.00 0.00 N ATOM 746 CA LYS A 403 -16.956 -2.744 -2.420 1.00 0.00 C ATOM 747 C LYS A 403 -15.877 -1.944 -1.689 1.00 0.00 C ATOM 748 O LYS A 403 -16.071 -1.504 -0.556 1.00 0.00 O ATOM 749 CB LYS A 403 -18.038 -1.793 -2.926 1.00 0.00 C ATOM 750 CG LYS A 403 -19.014 -2.442 -3.893 1.00 0.00 C ATOM 751 CD LYS A 403 -18.399 -2.639 -5.270 1.00 0.00 C ATOM 752 CE LYS A 403 -18.045 -1.308 -5.919 1.00 0.00 C ATOM 753 NZ LYS A 403 -17.454 -1.488 -7.274 1.00 0.00 N ATOM 0 H LYS A 403 -17.658 -3.512 -0.594 1.00 0.00 H new ATOM 0 HA LYS A 403 -16.476 -3.254 -3.255 1.00 0.00 H new ATOM 0 HB2 LYS A 403 -18.592 -1.399 -2.074 1.00 0.00 H new ATOM 0 HB3 LYS A 403 -17.563 -0.944 -3.417 1.00 0.00 H new ATOM 0 HG2 LYS A 403 -19.332 -3.406 -3.496 1.00 0.00 H new ATOM 0 HG3 LYS A 403 -19.907 -1.822 -3.979 1.00 0.00 H new ATOM 0 HD2 LYS A 403 -17.503 -3.253 -5.185 1.00 0.00 H new ATOM 0 HD3 LYS A 403 -19.097 -3.181 -5.907 1.00 0.00 H new ATOM 0 HE2 LYS A 403 -18.941 -0.691 -5.993 1.00 0.00 H new ATOM 0 HE3 LYS A 403 -17.340 -0.771 -5.284 1.00 0.00 H new ATOM 0 HZ1 LYS A 403 -17.228 -0.558 -7.680 1.00 0.00 H new ATOM 0 HZ2 LYS A 403 -16.585 -2.055 -7.201 1.00 0.00 H new ATOM 0 HZ3 LYS A 403 -18.136 -1.977 -7.888 1.00 0.00 H new ATOM 767 N CYS A 404 -14.749 -1.740 -2.368 1.00 0.00 N ATOM 768 CA CYS A 404 -13.636 -0.968 -1.817 1.00 0.00 C ATOM 769 C CYS A 404 -13.702 0.472 -2.329 1.00 0.00 C ATOM 770 O CYS A 404 -13.957 0.700 -3.511 1.00 0.00 O ATOM 771 CB CYS A 404 -12.298 -1.605 -2.215 1.00 0.00 C ATOM 772 SG CYS A 404 -10.826 -0.697 -1.637 1.00 0.00 S ATOM 0 H CYS A 404 -14.581 -2.101 -3.307 1.00 0.00 H new ATOM 0 HA CYS A 404 -13.712 -0.966 -0.730 1.00 0.00 H new ATOM 0 HB2 CYS A 404 -12.262 -2.620 -1.820 1.00 0.00 H new ATOM 0 HB3 CYS A 404 -12.257 -1.684 -3.301 1.00 0.00 H new ATOM 777 N THR A 405 -13.486 1.442 -1.442 1.00 0.00 N ATOM 778 CA THR A 405 -13.541 2.850 -1.831 1.00 0.00 C ATOM 779 C THR A 405 -12.477 3.682 -1.120 1.00 0.00 C ATOM 780 O THR A 405 -12.203 3.484 0.063 1.00 0.00 O ATOM 781 CB THR A 405 -14.923 3.463 -1.535 1.00 0.00 C ATOM 782 OG1 THR A 405 -15.199 3.394 -0.131 1.00 0.00 O ATOM 783 CG2 THR A 405 -16.017 2.738 -2.307 1.00 0.00 C ATOM 0 H THR A 405 -13.273 1.281 -0.458 1.00 0.00 H new ATOM 0 HA THR A 405 -13.352 2.873 -2.904 1.00 0.00 H new ATOM 0 HB THR A 405 -14.907 4.506 -1.853 1.00 0.00 H new ATOM 0 HG1 THR A 405 -15.708 2.579 0.063 1.00 0.00 H new ATOM 0 HG21 THR A 405 -16.983 3.190 -2.081 1.00 0.00 H new ATOM 0 HG22 THR A 405 -15.821 2.817 -3.376 1.00 0.00 H new ATOM 0 HG23 THR A 405 -16.031 1.687 -2.018 1.00 0.00 H new ATOM 791 N LEU A 406 -11.885 4.617 -1.860 1.00 0.00 N ATOM 792 CA LEU A 406 -10.850 5.494 -1.326 1.00 0.00 C ATOM 793 C LEU A 406 -11.441 6.495 -0.344 1.00 0.00 C ATOM 794 O LEU A 406 -12.547 7.001 -0.540 1.00 0.00 O ATOM 795 CB LEU A 406 -10.144 6.228 -2.471 1.00 0.00 C ATOM 796 CG LEU A 406 -8.850 6.968 -2.104 1.00 0.00 C ATOM 797 CD1 LEU A 406 -9.144 8.278 -1.391 1.00 0.00 C ATOM 798 CD2 LEU A 406 -7.949 6.086 -1.251 1.00 0.00 C ATOM 0 H LEU A 406 -12.109 4.786 -2.841 1.00 0.00 H new ATOM 0 HA LEU A 406 -10.122 4.883 -0.792 1.00 0.00 H new ATOM 0 HB2 LEU A 406 -9.915 5.504 -3.253 1.00 0.00 H new ATOM 0 HB3 LEU A 406 -10.842 6.948 -2.898 1.00 0.00 H new ATOM 0 HG LEU A 406 -8.328 7.202 -3.032 1.00 0.00 H new ATOM 0 HD11 LEU A 406 -8.207 8.777 -1.145 1.00 0.00 H new ATOM 0 HD12 LEU A 406 -9.738 8.921 -2.041 1.00 0.00 H new ATOM 0 HD13 LEU A 406 -9.699 8.077 -0.475 1.00 0.00 H new ATOM 0 HD21 LEU A 406 -7.038 6.630 -1.002 1.00 0.00 H new ATOM 0 HD22 LEU A 406 -8.470 5.813 -0.334 1.00 0.00 H new ATOM 0 HD23 LEU A 406 -7.693 5.183 -1.806 1.00 0.00 H new ATOM 810 N ASP A 407 -10.683 6.786 0.702 1.00 0.00 N ATOM 811 CA ASP A 407 -11.107 7.740 1.717 1.00 0.00 C ATOM 812 C ASP A 407 -10.101 8.880 1.797 1.00 0.00 C ATOM 813 O ASP A 407 -8.899 8.646 1.896 1.00 0.00 O ATOM 814 CB ASP A 407 -11.240 7.049 3.077 1.00 0.00 C ATOM 815 CG ASP A 407 -11.820 7.961 4.141 1.00 0.00 C ATOM 816 OD1 ASP A 407 -11.210 9.012 4.423 1.00 0.00 O ATOM 817 OD2 ASP A 407 -12.889 7.622 4.693 1.00 0.00 O ATOM 0 H ASP A 407 -9.766 6.373 0.871 1.00 0.00 H new ATOM 0 HA ASP A 407 -12.082 8.143 1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 407 -11.875 6.169 2.973 1.00 0.00 H new ATOM 0 HB3 ASP A 407 -10.260 6.698 3.400 1.00 0.00 H new ATOM 822 N LYS A 408 -10.594 10.111 1.730 1.00 0.00 N ATOM 823 CA LYS A 408 -9.725 11.281 1.773 1.00 0.00 C ATOM 824 C LYS A 408 -8.984 11.388 3.101 1.00 0.00 C ATOM 825 O LYS A 408 -7.762 11.526 3.125 1.00 0.00 O ATOM 826 CB LYS A 408 -10.538 12.551 1.527 1.00 0.00 C ATOM 827 CG LYS A 408 -11.200 12.595 0.159 1.00 0.00 C ATOM 828 CD LYS A 408 -10.168 12.646 -0.958 1.00 0.00 C ATOM 829 CE LYS A 408 -10.831 12.644 -2.327 1.00 0.00 C ATOM 830 NZ LYS A 408 -11.632 11.409 -2.553 1.00 0.00 N ATOM 0 H LYS A 408 -11.588 10.325 1.646 1.00 0.00 H new ATOM 0 HA LYS A 408 -8.981 11.166 0.985 1.00 0.00 H new ATOM 0 HB2 LYS A 408 -11.306 12.635 2.296 1.00 0.00 H new ATOM 0 HB3 LYS A 408 -9.884 13.417 1.633 1.00 0.00 H new ATOM 0 HG2 LYS A 408 -11.833 11.717 0.031 1.00 0.00 H new ATOM 0 HG3 LYS A 408 -11.850 13.468 0.096 1.00 0.00 H new ATOM 0 HD2 LYS A 408 -9.556 13.542 -0.850 1.00 0.00 H new ATOM 0 HD3 LYS A 408 -9.498 11.790 -0.875 1.00 0.00 H new ATOM 0 HE2 LYS A 408 -11.476 13.518 -2.419 1.00 0.00 H new ATOM 0 HE3 LYS A 408 -10.068 12.729 -3.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 408 -11.855 11.320 -3.565 1.00 0.00 H new ATOM 0 HZ2 LYS A 408 -11.085 10.580 -2.245 1.00 0.00 H new ATOM 0 HZ3 LYS A 408 -12.516 11.464 -2.007 1.00 0.00 H new ATOM 844 N GLU A 409 -9.725 11.331 4.204 1.00 0.00 N ATOM 845 CA GLU A 409 -9.128 11.430 5.533 1.00 0.00 C ATOM 846 C GLU A 409 -8.058 10.362 5.735 1.00 0.00 C ATOM 847 O GLU A 409 -6.926 10.665 6.120 1.00 0.00 O ATOM 848 CB GLU A 409 -10.207 11.297 6.609 1.00 0.00 C ATOM 849 CG GLU A 409 -11.313 12.336 6.499 1.00 0.00 C ATOM 850 CD GLU A 409 -10.813 13.755 6.692 1.00 0.00 C ATOM 851 OE1 GLU A 409 -9.976 14.209 5.882 1.00 0.00 O ATOM 852 OE2 GLU A 409 -11.259 14.414 7.655 1.00 0.00 O ATOM 0 H GLU A 409 -10.739 11.217 4.204 1.00 0.00 H new ATOM 0 HA GLU A 409 -8.656 12.409 5.618 1.00 0.00 H new ATOM 0 HB2 GLU A 409 -10.648 10.302 6.547 1.00 0.00 H new ATOM 0 HB3 GLU A 409 -9.740 11.379 7.591 1.00 0.00 H new ATOM 0 HG2 GLU A 409 -11.786 12.253 5.521 1.00 0.00 H new ATOM 0 HG3 GLU A 409 -12.080 12.122 7.243 1.00 0.00 H new ATOM 859 N GLU A 410 -8.423 9.115 5.466 1.00 0.00 N ATOM 860 CA GLU A 410 -7.496 8.000 5.612 1.00 0.00 C ATOM 861 C GLU A 410 -6.307 8.165 4.672 1.00 0.00 C ATOM 862 O GLU A 410 -5.170 7.895 5.049 1.00 0.00 O ATOM 863 CB GLU A 410 -8.210 6.673 5.342 1.00 0.00 C ATOM 864 CG GLU A 410 -9.373 6.411 6.286 1.00 0.00 C ATOM 865 CD GLU A 410 -10.023 5.060 6.058 1.00 0.00 C ATOM 866 OE1 GLU A 410 -9.546 4.313 5.178 1.00 0.00 O ATOM 867 OE2 GLU A 410 -11.005 4.747 6.762 1.00 0.00 O ATOM 0 H GLU A 410 -9.354 8.850 5.146 1.00 0.00 H new ATOM 0 HA GLU A 410 -7.126 7.993 6.637 1.00 0.00 H new ATOM 0 HB2 GLU A 410 -8.577 6.668 4.315 1.00 0.00 H new ATOM 0 HB3 GLU A 410 -7.491 5.858 5.428 1.00 0.00 H new ATOM 0 HG2 GLU A 410 -9.020 6.470 7.315 1.00 0.00 H new ATOM 0 HG3 GLU A 410 -10.120 7.194 6.160 1.00 0.00 H new ATOM 874 N ALA A 411 -6.580 8.618 3.454 1.00 0.00 N ATOM 875 CA ALA A 411 -5.532 8.833 2.462 1.00 0.00 C ATOM 876 C ALA A 411 -4.508 9.840 2.969 1.00 0.00 C ATOM 877 O ALA A 411 -3.308 9.691 2.746 1.00 0.00 O ATOM 878 CB ALA A 411 -6.137 9.315 1.152 1.00 0.00 C ATOM 0 H ALA A 411 -7.520 8.844 3.129 1.00 0.00 H new ATOM 0 HA ALA A 411 -5.025 7.884 2.289 1.00 0.00 H new ATOM 0 HB1 ALA A 411 -5.344 9.471 0.421 1.00 0.00 H new ATOM 0 HB2 ALA A 411 -6.835 8.566 0.776 1.00 0.00 H new ATOM 0 HB3 ALA A 411 -6.667 10.253 1.319 1.00 0.00 H new ATOM 884 N LYS A 412 -4.995 10.864 3.656 1.00 0.00 N ATOM 885 CA LYS A 412 -4.127 11.895 4.203 1.00 0.00 C ATOM 886 C LYS A 412 -3.126 11.286 5.178 1.00 0.00 C ATOM 887 O LYS A 412 -1.926 11.542 5.094 1.00 0.00 O ATOM 888 CB LYS A 412 -4.965 12.960 4.910 1.00 0.00 C ATOM 889 CG LYS A 412 -5.873 13.738 3.973 1.00 0.00 C ATOM 890 CD LYS A 412 -6.839 14.623 4.743 1.00 0.00 C ATOM 891 CE LYS A 412 -7.718 15.436 3.807 1.00 0.00 C ATOM 892 NZ LYS A 412 -8.520 14.566 2.904 1.00 0.00 N ATOM 0 H LYS A 412 -5.987 11.002 3.847 1.00 0.00 H new ATOM 0 HA LYS A 412 -3.577 12.359 3.385 1.00 0.00 H new ATOM 0 HB2 LYS A 412 -5.573 12.482 5.678 1.00 0.00 H new ATOM 0 HB3 LYS A 412 -4.299 13.657 5.419 1.00 0.00 H new ATOM 0 HG2 LYS A 412 -5.269 14.352 3.305 1.00 0.00 H new ATOM 0 HG3 LYS A 412 -6.434 13.043 3.348 1.00 0.00 H new ATOM 0 HD2 LYS A 412 -7.465 14.005 5.387 1.00 0.00 H new ATOM 0 HD3 LYS A 412 -6.279 15.295 5.393 1.00 0.00 H new ATOM 0 HE2 LYS A 412 -8.387 16.066 4.393 1.00 0.00 H new ATOM 0 HE3 LYS A 412 -7.095 16.102 3.210 1.00 0.00 H new ATOM 0 HZ1 LYS A 412 -9.143 15.156 2.317 1.00 0.00 H new ATOM 0 HZ2 LYS A 412 -7.882 14.020 2.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 412 -9.096 13.913 3.473 1.00 0.00 H new ATOM 906 N LYS A 413 -3.633 10.473 6.100 1.00 0.00 N ATOM 907 CA LYS A 413 -2.789 9.821 7.095 1.00 0.00 C ATOM 908 C LYS A 413 -1.855 8.802 6.445 1.00 0.00 C ATOM 909 O LYS A 413 -0.662 8.758 6.748 1.00 0.00 O ATOM 910 CB LYS A 413 -3.657 9.127 8.145 1.00 0.00 C ATOM 911 CG LYS A 413 -4.656 10.054 8.817 1.00 0.00 C ATOM 912 CD LYS A 413 -3.961 11.170 9.582 1.00 0.00 C ATOM 913 CE LYS A 413 -4.961 12.107 10.240 1.00 0.00 C ATOM 914 NZ LYS A 413 -4.286 13.203 10.990 1.00 0.00 N ATOM 0 H LYS A 413 -4.625 10.250 6.178 1.00 0.00 H new ATOM 0 HA LYS A 413 -2.180 10.588 7.574 1.00 0.00 H new ATOM 0 HB2 LYS A 413 -4.196 8.306 7.673 1.00 0.00 H new ATOM 0 HB3 LYS A 413 -3.011 8.689 8.906 1.00 0.00 H new ATOM 0 HG2 LYS A 413 -5.316 10.485 8.064 1.00 0.00 H new ATOM 0 HG3 LYS A 413 -5.283 9.480 9.500 1.00 0.00 H new ATOM 0 HD2 LYS A 413 -3.310 10.739 10.343 1.00 0.00 H new ATOM 0 HD3 LYS A 413 -3.325 11.736 8.902 1.00 0.00 H new ATOM 0 HE2 LYS A 413 -5.612 12.536 9.478 1.00 0.00 H new ATOM 0 HE3 LYS A 413 -5.597 11.540 10.920 1.00 0.00 H new ATOM 0 HZ1 LYS A 413 -5.003 13.820 11.424 1.00 0.00 H new ATOM 0 HZ2 LYS A 413 -3.684 12.795 11.734 1.00 0.00 H new ATOM 0 HZ3 LYS A 413 -3.699 13.760 10.337 1.00 0.00 H new ATOM 928 N VAL A 414 -2.411 7.982 5.558 1.00 0.00 N ATOM 929 CA VAL A 414 -1.636 6.956 4.869 1.00 0.00 C ATOM 930 C VAL A 414 -0.465 7.577 4.113 1.00 0.00 C ATOM 931 O VAL A 414 0.626 7.010 4.059 1.00 0.00 O ATOM 932 CB VAL A 414 -2.508 6.133 3.899 1.00 0.00 C ATOM 933 CG1 VAL A 414 -2.663 6.849 2.579 1.00 0.00 C ATOM 934 CG2 VAL A 414 -1.924 4.743 3.699 1.00 0.00 C ATOM 0 H VAL A 414 -3.397 8.009 5.299 1.00 0.00 H new ATOM 0 HA VAL A 414 -1.250 6.281 5.633 1.00 0.00 H new ATOM 0 HB VAL A 414 -3.499 6.023 4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 414 -3.282 6.250 1.911 1.00 0.00 H new ATOM 0 HG12 VAL A 414 -3.138 7.816 2.743 1.00 0.00 H new ATOM 0 HG13 VAL A 414 -1.682 6.998 2.129 1.00 0.00 H new ATOM 0 HG21 VAL A 414 -2.554 4.179 3.011 1.00 0.00 H new ATOM 0 HG22 VAL A 414 -0.919 4.827 3.285 1.00 0.00 H new ATOM 0 HG23 VAL A 414 -1.879 4.226 4.657 1.00 0.00 H new ATOM 944 N ALA A 415 -0.703 8.748 3.535 1.00 0.00 N ATOM 945 CA ALA A 415 0.326 9.457 2.789 1.00 0.00 C ATOM 946 C ALA A 415 1.396 10.000 3.726 1.00 0.00 C ATOM 947 O ALA A 415 2.583 10.003 3.397 1.00 0.00 O ATOM 948 CB ALA A 415 -0.293 10.587 1.979 1.00 0.00 C ATOM 0 H ALA A 415 -1.603 9.227 3.570 1.00 0.00 H new ATOM 0 HA ALA A 415 0.799 8.753 2.104 1.00 0.00 H new ATOM 0 HB1 ALA A 415 0.488 11.109 1.426 1.00 0.00 H new ATOM 0 HB2 ALA A 415 -1.021 10.177 1.279 1.00 0.00 H new ATOM 0 HB3 ALA A 415 -0.790 11.286 2.651 1.00 0.00 H new ATOM 954 N ASP A 416 0.967 10.463 4.897 1.00 0.00 N ATOM 955 CA ASP A 416 1.888 11.013 5.888 1.00 0.00 C ATOM 956 C ASP A 416 2.605 9.908 6.658 1.00 0.00 C ATOM 957 O ASP A 416 2.878 10.047 7.852 1.00 0.00 O ATOM 958 CB ASP A 416 1.144 11.929 6.861 1.00 0.00 C ATOM 959 CG ASP A 416 0.594 13.171 6.187 1.00 0.00 C ATOM 960 OD1 ASP A 416 1.389 13.913 5.573 1.00 0.00 O ATOM 961 OD2 ASP A 416 -0.628 13.406 6.279 1.00 0.00 O ATOM 0 H ASP A 416 -0.012 10.468 5.183 1.00 0.00 H new ATOM 0 HA ASP A 416 2.638 11.595 5.352 1.00 0.00 H new ATOM 0 HB2 ASP A 416 0.325 11.376 7.320 1.00 0.00 H new ATOM 0 HB3 ASP A 416 1.819 12.225 7.664 1.00 0.00 H new ATOM 966 N GLU A 417 2.916 8.817 5.967 1.00 0.00 N ATOM 967 CA GLU A 417 3.609 7.692 6.583 1.00 0.00 C ATOM 968 C GLU A 417 4.172 6.753 5.519 1.00 0.00 C ATOM 969 O GLU A 417 4.185 5.534 5.693 1.00 0.00 O ATOM 970 CB GLU A 417 2.662 6.930 7.510 1.00 0.00 C ATOM 971 CG GLU A 417 1.468 6.315 6.798 1.00 0.00 C ATOM 972 CD GLU A 417 0.550 5.560 7.741 1.00 0.00 C ATOM 973 OE1 GLU A 417 1.022 4.601 8.387 1.00 0.00 O ATOM 974 OE2 GLU A 417 -0.639 5.928 7.831 1.00 0.00 O ATOM 0 H GLU A 417 2.699 8.688 4.979 1.00 0.00 H new ATOM 0 HA GLU A 417 4.440 8.083 7.170 1.00 0.00 H new ATOM 0 HB2 GLU A 417 3.219 6.140 8.013 1.00 0.00 H new ATOM 0 HB3 GLU A 417 2.302 7.608 8.283 1.00 0.00 H new ATOM 0 HG2 GLU A 417 0.902 7.102 6.299 1.00 0.00 H new ATOM 0 HG3 GLU A 417 1.823 5.637 6.022 1.00 0.00 H new ATOM 981 N THR A 418 4.649 7.337 4.422 1.00 0.00 N ATOM 982 CA THR A 418 5.227 6.565 3.327 1.00 0.00 C ATOM 983 C THR A 418 5.749 7.486 2.227 1.00 0.00 C ATOM 984 O THR A 418 5.700 7.150 1.043 1.00 0.00 O ATOM 985 CB THR A 418 4.204 5.584 2.725 1.00 0.00 C ATOM 986 OG1 THR A 418 4.812 4.812 1.682 1.00 0.00 O ATOM 987 CG2 THR A 418 3.009 6.338 2.176 1.00 0.00 C ATOM 0 H THR A 418 4.646 8.345 4.269 1.00 0.00 H new ATOM 0 HA THR A 418 6.056 5.993 3.744 1.00 0.00 H new ATOM 0 HB THR A 418 3.865 4.912 3.514 1.00 0.00 H new ATOM 0 HG1 THR A 418 5.243 5.413 1.039 1.00 0.00 H new ATOM 0 HG21 THR A 418 2.295 5.631 1.754 1.00 0.00 H new ATOM 0 HG22 THR A 418 2.532 6.899 2.980 1.00 0.00 H new ATOM 0 HG23 THR A 418 3.339 7.027 1.399 1.00 0.00 H new ATOM 995 N ALA A 419 6.255 8.649 2.631 1.00 0.00 N ATOM 996 CA ALA A 419 6.793 9.625 1.687 1.00 0.00 C ATOM 997 C ALA A 419 7.338 10.847 2.419 1.00 0.00 C ATOM 998 O ALA A 419 8.519 11.178 2.303 1.00 0.00 O ATOM 999 CB ALA A 419 5.719 10.044 0.693 1.00 0.00 C ATOM 0 H ALA A 419 6.304 8.939 3.608 1.00 0.00 H new ATOM 0 HA ALA A 419 7.614 9.157 1.144 1.00 0.00 H new ATOM 0 HB1 ALA A 419 6.133 10.772 -0.005 1.00 0.00 H new ATOM 0 HB2 ALA A 419 5.372 9.170 0.142 1.00 0.00 H new ATOM 0 HB3 ALA A 419 4.882 10.491 1.229 1.00 0.00 H new ATOM 1005 N LYS A 420 6.465 11.506 3.178 1.00 0.00 N ATOM 1006 CA LYS A 420 6.830 12.688 3.945 1.00 0.00 C ATOM 1007 C LYS A 420 7.669 13.657 3.114 1.00 0.00 C ATOM 1008 O LYS A 420 8.598 14.285 3.624 1.00 0.00 O ATOM 1009 CB LYS A 420 7.588 12.281 5.205 1.00 0.00 C ATOM 1010 CG LYS A 420 7.624 13.377 6.250 1.00 0.00 C ATOM 1011 CD LYS A 420 8.422 12.964 7.475 1.00 0.00 C ATOM 1012 CE LYS A 420 8.491 14.089 8.494 1.00 0.00 C ATOM 1013 NZ LYS A 420 9.149 15.303 7.935 1.00 0.00 N ATOM 0 H LYS A 420 5.487 11.234 3.276 1.00 0.00 H new ATOM 0 HA LYS A 420 5.911 13.202 4.228 1.00 0.00 H new ATOM 0 HB2 LYS A 420 7.122 11.393 5.633 1.00 0.00 H new ATOM 0 HB3 LYS A 420 8.609 12.008 4.937 1.00 0.00 H new ATOM 0 HG2 LYS A 420 8.062 14.277 5.818 1.00 0.00 H new ATOM 0 HG3 LYS A 420 6.606 13.629 6.547 1.00 0.00 H new ATOM 0 HD2 LYS A 420 7.965 12.086 7.930 1.00 0.00 H new ATOM 0 HD3 LYS A 420 9.431 12.679 7.176 1.00 0.00 H new ATOM 0 HE2 LYS A 420 7.484 14.342 8.825 1.00 0.00 H new ATOM 0 HE3 LYS A 420 9.040 13.750 9.373 1.00 0.00 H new ATOM 0 HZ1 LYS A 420 9.437 15.931 8.712 1.00 0.00 H new ATOM 0 HZ2 LYS A 420 9.988 15.022 7.388 1.00 0.00 H new ATOM 0 HZ3 LYS A 420 8.482 15.804 7.314 1.00 0.00 H new ATOM 1027 N ASP A 421 7.334 13.780 1.834 1.00 0.00 N ATOM 1028 CA ASP A 421 8.057 14.679 0.942 1.00 0.00 C ATOM 1029 C ASP A 421 7.726 16.134 1.257 1.00 0.00 C ATOM 1030 O ASP A 421 8.616 16.982 1.334 1.00 0.00 O ATOM 1031 CB ASP A 421 7.722 14.371 -0.518 1.00 0.00 C ATOM 1032 CG ASP A 421 8.176 12.987 -0.938 1.00 0.00 C ATOM 1033 OD1 ASP A 421 7.721 12.001 -0.322 1.00 0.00 O ATOM 1034 OD2 ASP A 421 8.987 12.890 -1.882 1.00 0.00 O ATOM 0 H ASP A 421 6.569 13.270 1.392 1.00 0.00 H new ATOM 0 HA ASP A 421 9.124 14.523 1.098 1.00 0.00 H new ATOM 0 HB2 ASP A 421 6.646 14.457 -0.666 1.00 0.00 H new ATOM 0 HB3 ASP A 421 8.193 15.115 -1.160 1.00 0.00 H new ATOM 1039 N GLY A 422 6.438 16.414 1.438 1.00 0.00 N ATOM 1040 CA GLY A 422 6.003 17.765 1.742 1.00 0.00 C ATOM 1041 C GLY A 422 6.358 18.749 0.647 1.00 0.00 C ATOM 1042 O GLY A 422 6.724 19.892 0.925 1.00 0.00 O ATOM 0 H GLY A 422 5.687 15.727 1.379 1.00 0.00 H new ATOM 0 HA2 GLY A 422 4.924 17.770 1.895 1.00 0.00 H new ATOM 0 HA3 GLY A 422 6.459 18.088 2.678 1.00 0.00 H new ATOM 1046 N LYS A 423 6.246 18.307 -0.601 1.00 0.00 N ATOM 1047 CA LYS A 423 6.554 19.157 -1.746 1.00 0.00 C ATOM 1048 C LYS A 423 5.517 20.266 -1.890 1.00 0.00 C ATOM 1049 O LYS A 423 5.863 21.429 -2.098 1.00 0.00 O ATOM 1050 CB LYS A 423 6.611 18.321 -3.027 1.00 0.00 C ATOM 1051 CG LYS A 423 6.892 19.138 -4.279 1.00 0.00 C ATOM 1052 CD LYS A 423 6.982 18.253 -5.512 1.00 0.00 C ATOM 1053 CE LYS A 423 7.212 19.072 -6.772 1.00 0.00 C ATOM 1054 NZ LYS A 423 6.094 20.020 -7.031 1.00 0.00 N ATOM 0 H LYS A 423 5.944 17.364 -0.846 1.00 0.00 H new ATOM 0 HA LYS A 423 7.529 19.615 -1.579 1.00 0.00 H new ATOM 0 HB2 LYS A 423 7.384 17.560 -2.919 1.00 0.00 H new ATOM 0 HB3 LYS A 423 5.663 17.797 -3.151 1.00 0.00 H new ATOM 0 HG2 LYS A 423 6.103 19.877 -4.417 1.00 0.00 H new ATOM 0 HG3 LYS A 423 7.825 19.687 -4.155 1.00 0.00 H new ATOM 0 HD2 LYS A 423 7.795 17.538 -5.389 1.00 0.00 H new ATOM 0 HD3 LYS A 423 6.063 17.676 -5.615 1.00 0.00 H new ATOM 0 HE2 LYS A 423 8.145 19.628 -6.678 1.00 0.00 H new ATOM 0 HE3 LYS A 423 7.325 18.402 -7.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 423 6.175 20.396 -7.997 1.00 0.00 H new ATOM 0 HZ2 LYS A 423 5.186 19.523 -6.928 1.00 0.00 H new ATOM 0 HZ3 LYS A 423 6.139 20.804 -6.349 1.00 0.00 H new ATOM 1068 N THR A 424 4.244 19.894 -1.777 1.00 0.00 N ATOM 1069 CA THR A 424 3.149 20.850 -1.894 1.00 0.00 C ATOM 1070 C THR A 424 3.217 21.581 -3.240 1.00 0.00 C ATOM 1071 O THR A 424 3.225 20.941 -4.292 1.00 0.00 O ATOM 1072 CB THR A 424 3.165 21.866 -0.732 1.00 0.00 C ATOM 1073 OG1 THR A 424 3.394 21.183 0.507 1.00 0.00 O ATOM 1074 CG2 THR A 424 1.844 22.620 -0.650 1.00 0.00 C ATOM 0 H THR A 424 3.946 18.934 -1.604 1.00 0.00 H new ATOM 0 HA THR A 424 2.213 20.293 -1.842 1.00 0.00 H new ATOM 0 HB THR A 424 3.967 22.581 -0.917 1.00 0.00 H new ATOM 0 HG1 THR A 424 3.405 21.832 1.241 1.00 0.00 H new ATOM 0 HG21 THR A 424 1.881 23.330 0.177 1.00 0.00 H new ATOM 0 HG22 THR A 424 1.674 23.158 -1.583 1.00 0.00 H new ATOM 0 HG23 THR A 424 1.031 21.913 -0.485 1.00 0.00 H new ATOM 1082 N GLY A 425 3.269 22.912 -3.211 1.00 0.00 N ATOM 1083 CA GLY A 425 3.336 23.675 -4.444 1.00 0.00 C ATOM 1084 C GLY A 425 3.334 25.171 -4.200 1.00 0.00 C ATOM 1085 O GLY A 425 2.612 25.913 -4.867 1.00 0.00 O ATOM 0 H GLY A 425 3.266 23.472 -2.358 1.00 0.00 H new ATOM 0 HA2 GLY A 425 4.239 23.400 -4.989 1.00 0.00 H new ATOM 0 HA3 GLY A 425 2.489 23.412 -5.077 1.00 0.00 H new ATOM 1089 N ASN A 426 4.142 25.612 -3.241 1.00 0.00 N ATOM 1090 CA ASN A 426 4.230 27.028 -2.907 1.00 0.00 C ATOM 1091 C ASN A 426 4.728 27.840 -4.100 1.00 0.00 C ATOM 1092 O ASN A 426 5.658 27.432 -4.796 1.00 0.00 O ATOM 1093 CB ASN A 426 5.159 27.238 -1.709 1.00 0.00 C ATOM 1094 CG ASN A 426 6.574 26.765 -1.980 1.00 0.00 C ATOM 1095 OD1 ASN A 426 6.802 25.592 -2.277 1.00 0.00 O ATOM 1096 ND2 ASN A 426 7.533 27.678 -1.876 1.00 0.00 N ATOM 0 H ASN A 426 4.745 25.009 -2.682 1.00 0.00 H new ATOM 0 HA ASN A 426 3.230 27.374 -2.646 1.00 0.00 H new ATOM 0 HB2 ASN A 426 5.177 28.296 -1.449 1.00 0.00 H new ATOM 0 HB3 ASN A 426 4.760 26.704 -0.846 1.00 0.00 H new ATOM 0 HD21 ASN A 426 8.505 27.418 -2.045 1.00 0.00 H new ATOM 0 HD22 ASN A 426 7.298 28.639 -1.627 1.00 0.00 H new ATOM 1103 N THR A 427 4.102 28.989 -4.326 1.00 0.00 N ATOM 1104 CA THR A 427 4.476 29.863 -5.431 1.00 0.00 C ATOM 1105 C THR A 427 5.923 30.324 -5.299 1.00 0.00 C ATOM 1106 O THR A 427 6.376 30.667 -4.206 1.00 0.00 O ATOM 1107 CB THR A 427 3.561 31.099 -5.504 1.00 0.00 C ATOM 1108 OG1 THR A 427 3.660 31.854 -4.290 1.00 0.00 O ATOM 1109 CG2 THR A 427 2.114 30.687 -5.734 1.00 0.00 C ATOM 0 H THR A 427 3.331 29.338 -3.757 1.00 0.00 H new ATOM 0 HA THR A 427 4.363 29.282 -6.347 1.00 0.00 H new ATOM 0 HB THR A 427 3.885 31.716 -6.342 1.00 0.00 H new ATOM 0 HG1 THR A 427 3.077 32.639 -4.345 1.00 0.00 H new ATOM 0 HG21 THR A 427 1.486 31.576 -5.782 1.00 0.00 H new ATOM 0 HG22 THR A 427 2.037 30.137 -6.672 1.00 0.00 H new ATOM 0 HG23 THR A 427 1.782 30.052 -4.913 1.00 0.00 H new ATOM 1117 N ASN A 428 6.642 30.336 -6.420 1.00 0.00 N ATOM 1118 CA ASN A 428 8.036 30.759 -6.439 1.00 0.00 C ATOM 1119 C ASN A 428 8.573 30.711 -7.861 1.00 0.00 C ATOM 1120 O ASN A 428 9.129 31.688 -8.363 1.00 0.00 O ATOM 1121 CB ASN A 428 8.886 29.869 -5.526 1.00 0.00 C ATOM 1122 CG ASN A 428 10.341 30.291 -5.497 1.00 0.00 C ATOM 1123 OD1 ASN A 428 10.667 31.412 -5.107 1.00 0.00 O ATOM 1124 ND2 ASN A 428 11.225 29.391 -5.909 1.00 0.00 N ATOM 0 H ASN A 428 6.277 30.055 -7.330 1.00 0.00 H new ATOM 0 HA ASN A 428 8.092 31.783 -6.069 1.00 0.00 H new ATOM 0 HB2 ASN A 428 8.482 29.900 -4.514 1.00 0.00 H new ATOM 0 HB3 ASN A 428 8.817 28.835 -5.865 1.00 0.00 H new ATOM 0 HD21 ASN A 428 12.220 29.617 -5.911 1.00 0.00 H new ATOM 0 HD22 ASN A 428 10.910 28.474 -6.224 1.00 0.00 H new ATOM 1131 N THR A 429 8.375 29.572 -8.511 1.00 0.00 N ATOM 1132 CA THR A 429 8.808 29.392 -9.886 1.00 0.00 C ATOM 1133 C THR A 429 8.037 30.346 -10.791 1.00 0.00 C ATOM 1134 O THR A 429 7.026 30.913 -10.374 1.00 0.00 O ATOM 1135 CB THR A 429 8.587 27.939 -10.356 1.00 0.00 C ATOM 1136 OG1 THR A 429 9.183 27.029 -9.423 1.00 0.00 O ATOM 1137 CG2 THR A 429 9.185 27.707 -11.736 1.00 0.00 C ATOM 0 H THR A 429 7.915 28.757 -8.104 1.00 0.00 H new ATOM 0 HA THR A 429 9.875 29.608 -9.940 1.00 0.00 H new ATOM 0 HB THR A 429 7.512 27.765 -10.411 1.00 0.00 H new ATOM 0 HG1 THR A 429 9.038 26.108 -9.726 1.00 0.00 H new ATOM 0 HG21 THR A 429 9.012 26.674 -12.038 1.00 0.00 H new ATOM 0 HG22 THR A 429 8.714 28.379 -12.454 1.00 0.00 H new ATOM 0 HG23 THR A 429 10.257 27.902 -11.705 1.00 0.00 H new ATOM 1145 N THR A 430 8.514 30.530 -12.015 1.00 0.00 N ATOM 1146 CA THR A 430 7.856 31.422 -12.962 1.00 0.00 C ATOM 1147 C THR A 430 6.572 30.789 -13.508 1.00 0.00 C ATOM 1148 O THR A 430 6.330 30.792 -14.716 1.00 0.00 O ATOM 1149 CB THR A 430 8.797 31.783 -14.130 1.00 0.00 C ATOM 1150 OG1 THR A 430 10.072 32.191 -13.619 1.00 0.00 O ATOM 1151 CG2 THR A 430 8.215 32.907 -14.977 1.00 0.00 C ATOM 0 H THR A 430 9.353 30.075 -12.375 1.00 0.00 H new ATOM 0 HA THR A 430 7.598 32.336 -12.426 1.00 0.00 H new ATOM 0 HB THR A 430 8.912 30.898 -14.756 1.00 0.00 H new ATOM 0 HG1 THR A 430 10.666 32.417 -14.365 1.00 0.00 H new ATOM 0 HG21 THR A 430 8.900 33.140 -15.792 1.00 0.00 H new ATOM 0 HG22 THR A 430 7.255 32.594 -15.388 1.00 0.00 H new ATOM 0 HG23 THR A 430 8.073 33.793 -14.358 1.00 0.00 H new ATOM 1159 N GLY A 431 5.750 30.242 -12.612 1.00 0.00 N ATOM 1160 CA GLY A 431 4.509 29.616 -13.033 1.00 0.00 C ATOM 1161 C GLY A 431 3.791 28.923 -11.892 1.00 0.00 C ATOM 1162 O GLY A 431 4.403 28.173 -11.130 1.00 0.00 O ATOM 0 H GLY A 431 5.922 30.222 -11.607 1.00 0.00 H new ATOM 0 HA2 GLY A 431 3.853 30.372 -13.465 1.00 0.00 H new ATOM 0 HA3 GLY A 431 4.720 28.891 -13.819 1.00 0.00 H new ATOM 1166 N SER A 432 2.489 29.169 -11.774 1.00 0.00 N ATOM 1167 CA SER A 432 1.690 28.558 -10.719 1.00 0.00 C ATOM 1168 C SER A 432 1.606 27.048 -10.913 1.00 0.00 C ATOM 1169 O SER A 432 1.286 26.572 -12.002 1.00 0.00 O ATOM 1170 CB SER A 432 0.283 29.161 -10.697 1.00 0.00 C ATOM 1171 OG SER A 432 -0.376 28.962 -11.936 1.00 0.00 O ATOM 0 H SER A 432 1.967 29.786 -12.396 1.00 0.00 H new ATOM 0 HA SER A 432 2.176 28.760 -9.765 1.00 0.00 H new ATOM 0 HB2 SER A 432 -0.299 28.706 -9.895 1.00 0.00 H new ATOM 0 HB3 SER A 432 0.344 30.228 -10.481 1.00 0.00 H new ATOM 0 HG SER A 432 -0.052 28.135 -12.350 1.00 0.00 H new ATOM 1177 N SER A 433 1.893 26.302 -9.850 1.00 0.00 N ATOM 1178 CA SER A 433 1.851 24.844 -9.901 1.00 0.00 C ATOM 1179 C SER A 433 2.132 24.246 -8.527 1.00 0.00 C ATOM 1180 O SER A 433 3.131 24.655 -7.898 1.00 0.00 O ATOM 1181 CB SER A 433 2.870 24.317 -10.915 1.00 0.00 C ATOM 1182 OG SER A 433 2.848 22.900 -10.968 1.00 0.00 O ATOM 1183 OXT SER A 433 1.351 23.375 -8.090 1.00 0.00 O ATOM 0 H SER A 433 2.157 26.684 -8.942 1.00 0.00 H new ATOM 0 HA SER A 433 0.850 24.545 -10.213 1.00 0.00 H new ATOM 0 HB2 SER A 433 2.651 24.725 -11.902 1.00 0.00 H new ATOM 0 HB3 SER A 433 3.869 24.659 -10.644 1.00 0.00 H new ATOM 0 HG SER A 433 3.506 22.587 -11.623 1.00 0.00 H new TER 1189 SER A 433